CAS RN: 106021-56-1
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 110918-06-4
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 112406-59-4
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 112749-92-5
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 114933-32-3
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 117541-45-4
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 128635-21-2
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 141187-46-4
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 144288-73-3
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 230628-70-3
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 257278-99-2
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 27934-49-2
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 321750-20-3
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 64285-48-9
CAS Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]-1-propanesulfonate
OPENEYE Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
IUPAC Name: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[(Z)-[3-[(Z)-(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C29H32N2O3S3
MOLECULAR WEIGHT: 552.77098
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C\C4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
Structure:
CAS RN: 63868-46-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H28INO
MOLECULAR WEIGHT: 425.34689
SMILES: C[N+]1(CCC23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O)CC=C.[I-]
Structure:
CAS RN: 160681-90-3
CAS Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]-1-propanesulfonate; N,N-diethylethanamine
OPENEYE Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
IUPAC Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
SYSTEMATIC NAME: 3-[(2Z)-5-chloranyl-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
MOLECULAR FORMULA: C38H48ClN3O8S2
MOLECULAR WEIGHT: 774.38602
SMILES: CC/C(=C/C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCC(C)S(=O)(=O)O)/C=C\4/N(C5=C(O4)C=CC(=C5)Cl)CCCS(=O)(=O)[O-].CCN(CC)CC
Structure:
CAS RN: 285567-32-0
CAS Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]-1-propanesulfonate; N,N-diethylethanamine
OPENEYE Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
IUPAC Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
SYSTEMATIC NAME: 3-[(2Z)-5-chloranyl-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
MOLECULAR FORMULA: C38H48ClN3O8S2
MOLECULAR WEIGHT: 774.38602
SMILES: CC/C(=C/C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCC(C)S(=O)(=O)O)/C=C\4/N(C5=C(O4)C=CC(=C5)Cl)CCCS(=O)(=O)[O-].CCN(CC)CC
Structure:
CAS RN: 330568-97-3
CAS Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]-1-propanesulfonate; N,N-diethylethanamine
OPENEYE Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
IUPAC Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
SYSTEMATIC NAME: 3-[(2Z)-5-chloranyl-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
MOLECULAR FORMULA: C38H48ClN3O8S2
MOLECULAR WEIGHT: 774.38602
SMILES: CC/C(=C/C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCC(C)S(=O)(=O)O)/C=C\4/N(C5=C(O4)C=CC(=C5)Cl)CCCS(=O)(=O)[O-].CCN(CC)CC
Structure:
CAS RN: 415896-80-9
CAS Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]-1-propanesulfonate; N,N-diethylethanamine
OPENEYE Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
IUPAC Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
SYSTEMATIC NAME: 3-[(2Z)-5-chloranyl-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
MOLECULAR FORMULA: C38H48ClN3O8S2
MOLECULAR WEIGHT: 774.38602
SMILES: CC/C(=C/C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCC(C)S(=O)(=O)O)/C=C\4/N(C5=C(O4)C=CC(=C5)Cl)CCCS(=O)(=O)[O-].CCN(CC)CC
Structure:
CAS RN: 63148-90-3
CAS Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]-1-propanesulfonate; N,N-diethylethanamine
OPENEYE Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
IUPAC Name: 3-[(2Z)-5-chloro-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
SYSTEMATIC NAME: 3-[(2Z)-5-chloranyl-2-[(2Z)-2-[[5-phenyl-3-(3-sulfobutyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
MOLECULAR FORMULA: C38H48ClN3O8S2
MOLECULAR WEIGHT: 774.38602
SMILES: CC/C(=C/C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCC(C)S(=O)(=O)O)/C=C\4/N(C5=C(O4)C=CC(=C5)Cl)CCCS(=O)(=O)[O-].CCN(CC)CC
Structure:
CAS RN: 61925-94-8
CAS Name: (2S)-2-amino-3-phenyl-N-[(2R)-1-phenylpropan-2-yl]propanamide
OPENEYE Name: (2S)-2-amino-N-[(1R)-1-methyl-2-phenyl-ethyl]-3-phenyl-propanamide
IUPAC Name: (2S)-2-amino-3-phenyl-N-[(2R)-1-phenylpropan-2-yl]propanamide
SYSTEMATIC NAME: (2S)-2-azanyl-3-phenyl-N-[(2R)-1-phenylpropan-2-yl]propanamide
MOLECULAR FORMULA: C18H22N2O
MOLECULAR WEIGHT: 282.38008
SMILES: C[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)N
Structure:
CAS RN: 85562-33-0
CAS Name: (2S)-2-amino-3-phenyl-N-[(2R)-1-phenylpropan-2-yl]propanamide
OPENEYE Name: (2S)-2-amino-N-[(1R)-1-methyl-2-phenyl-ethyl]-3-phenyl-propanamide
IUPAC Name: (2S)-2-amino-3-phenyl-N-[(2R)-1-phenylpropan-2-yl]propanamide
SYSTEMATIC NAME: (2S)-2-azanyl-3-phenyl-N-[(2R)-1-phenylpropan-2-yl]propanamide
MOLECULAR FORMULA: C18H22N2O
MOLECULAR WEIGHT: 282.38008
SMILES: C[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)N
Structure:
CAS RN: 61764-15-6
CAS Name: (3Z)-3-[hydroxy-[(4-methyl-2-pyridinyl)amino]methylidene]-2-methyl-1,1-dioxo-4-benzo[h][1,2]benzothiazinone
OPENEYE Name: (3Z)-3-[hydroxy-[(4-methyl-2-pyridyl)amino]methylene]-2-methyl-1,1-dioxo-benzo[h][1,2]benzothiazin-4-one
IUPAC Name: (3Z)-3-[hydroxy-[(4-methylpyridin-2-yl)amino]methylidene]-2-methyl-1,1-dioxobenzo[h][1,2]benzothiazin-4-one
SYSTEMATIC NAME: (3Z)-2-methyl-3-[[(4-methylpyridin-2-yl)amino]-oxidanyl-methylidene]-1,1-bis(oxidanylidene)benzo[h][1,2]benzothiazin-4-one
MOLECULAR FORMULA: C20H17N3O4S
MOLECULAR WEIGHT: 395.43168
SMILES: CC1=CC(=NC=C1)N/C(=C/2\C(=O)C3=C(C4=CC=CC=C4C=C3)S(=O)(=O)N2C)/O
Structure:
CAS RN: 60281-90-5
CAS Name: (2Z,4S,4aS,5aS,6S,12aS)-2-[amino(hydroxy)methylidene]-7-chloro-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione; 4-amino-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide; (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(1-o
OPENEYE Name: (2Z,4S,4aS,5aS,6S,12aS)-2-[amino(hydroxy)methylene]-7-chloro-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione; 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide; (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phe
IUPAC Name: (2Z,4S,4aS,5aS,6S,12aS)-2-[amino(hydroxy)methylidene]-7-chloro-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione; 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide; (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-p
SYSTEMATIC NAME: (2Z,4S,4aS,5aS,6S,12aS)-2-[azanyl(oxidanyl)methylidene]-7-chloranyl-4-(dimethylamino)-6-methyl-6,10,11,12a-tetrakis(oxidanyl)-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione; 4-azanyl-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide; (2S,5R,6R)-3,3-dimethyl-7
MOLECULAR FORMULA: C50H55ClN8O14S2
MOLECULAR WEIGHT: 1091.5999
SMILES: CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C.C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)/C(=C(\N)/O)/C(=O)[C@]3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)N(C)C)O.CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C
Structure:
CAS RN: 56337-94-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H24N4O2
MOLECULAR WEIGHT: 352.43016
SMILES: C1C[C@H]([C@@H]2[C@@]34[C@@H]1[C@@H](CC5=C3C(=C(C=C5)O)O2)N(CC4)CC6CC6)N=[N+]=[N-]
Structure:
CAS RN: 54763-91-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H35NO7
MOLECULAR WEIGHT: 461.5479
SMILES: C[C@@H]1C2CC3=C([C@@]1(CCN2CC=C(C)C)C)C=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O
Structure:
CAS RN: 53632-66-9
CAS Name: aluminum; 2-ethoxyethanolate; (E)-1-ethoxy-3-oxo-1-buten-1-olate
OPENEYE Name: aluminum; 2-ethoxyethanolate; (E)-1-ethoxy-3-oxo-but-1-en-1-olate
IUPAC Name: aluminum; 2-ethoxyethanolate; (E)-1-ethoxy-3-oxobut-1-en-1-olate
SYSTEMATIC NAME: aluminum; 2-ethoxyethanolate; (E)-1-ethoxy-3-oxidanylidene-but-1-en-1-olate
MOLECULAR FORMULA: C14H27AlO7
MOLECULAR WEIGHT: 334.341518
SMILES: CCOCC[O-].CCOCC[O-].CCO/C(=C/C(=O)C)/[O-].[Al+3]
Structure:
CAS RN: 52333-30-9
CAS Name: disodium 6-imino-5-[[3-[4-[2-[4-[3-[(2-imino-8-oxo-6-sulfo-1-naphthalenyl)hydrazo]phenyl]sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonylphenyl]hydrazo]-4-oxo-2-naphthalenesulfonic acid
OPENEYE Name: disodium 6-imino-5-[2-[3-[4-[1-[4-[3-[2-(2-imino-8-oxo-6-sulfo-1-naphthyl)hydrazino]phenyl]sulfonyloxyphenyl]-1-methyl-ethyl]phenoxy]sulfonylphenyl]hydrazino]-4-oxo-naphthalene-2-sulfonic acid
IUPAC Name: disodium 6-imino-5-[2-[3-[4-[2-[4-[3-[2-(2-imino-8-oxo-6-sulfonaphthalen-1-yl)hydrazinyl]phenyl]sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonylphenyl]hydrazinyl]-4-oxonaphthalene-2-sulfonic acid
SYSTEMATIC NAME: disodium 6-azanylidene-5-[2-[3-[4-[2-[4-[3-[2-(2-azanylidene-8-oxidanylidene-6-sulfo-naphthalen-1-yl)hydrazinyl]phenyl]sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonylphenyl]hydrazinyl]-4-oxidanylidene-naphthalene-2-sulfonic acid
MOLECULAR FORMULA: C47H38N6Na2O14S4+2
MOLECULAR WEIGHT: 1085.07596
SMILES: CC(C)(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)O)C=CC3=N)C5=CC=C(C=C5)OS(=O)(=O)C6=CC=CC(=C6)NNC7=C8C(=CC(=CC8=O)S(=O)(=O)O)C=CC7=N.[Na+].[Na+]
Structure:
CAS RN: 52038-19-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H27NO6
MOLECULAR WEIGHT: 389.44218
SMILES: CN1CC[C@]23CC(=C(C(=O)[C@]2([C@H]1CC4=CC(=C(C=C34)OC)OC)O)OC)OC
Structure:
CAS RN: 51963-59-8
CAS Name: propan-2-yloxyphosphinous acid
OPENEYE Name: isopropoxyphosphinous acid
IUPAC Name: propan-2-yloxyphosphinous acid
SYSTEMATIC NAME: propan-2-yloxyphosphinous acid
MOLECULAR FORMULA: C3H9O2P
MOLECULAR WEIGHT: 108.076121
SMILES: CC(C)OPO
Structure:
CAS RN: 12223-88-0
CAS Name: (2Z)-2-(3-hydroxy-1H-quinolin-2-ylidene)-N,N-dimethyl-1,3-dioxo-5-indenecarboxamide
OPENEYE Name: (2Z)-2-(3-hydroxy-1H-quinolin-2-ylidene)-N,N-dimethyl-1,3-dioxo-indane-5-carboxamide
IUPAC Name: (2Z)-2-(3-hydroxy-1H-quinolin-2-ylidene)-N,N-dimethyl-1,3-dioxoindene-5-carboxamide
SYSTEMATIC NAME: (2Z)-N,N-dimethyl-1,3-bis(oxidanylidene)-2-(3-oxidanyl-1H-quinolin-2-ylidene)indene-5-carboxamide
MOLECULAR FORMULA: C21H16N2O4
MOLECULAR WEIGHT: 360.36274
SMILES: CN(C)C(=O)C1=CC2=C(C=C1)C(=O)/C(=C/3\C(=CC4=CC=CC=C4N3)O)/C2=O
Structure:
CAS RN: 43099-94-1
CAS Name: (2Z)-2-(3-hydroxy-1H-quinolin-2-ylidene)-N,N-dimethyl-1,3-dioxo-5-indenecarboxamide
OPENEYE Name: (2Z)-2-(3-hydroxy-1H-quinolin-2-ylidene)-N,N-dimethyl-1,3-dioxo-indane-5-carboxamide
IUPAC Name: (2Z)-2-(3-hydroxy-1H-quinolin-2-ylidene)-N,N-dimethyl-1,3-dioxoindene-5-carboxamide
SYSTEMATIC NAME: (2Z)-N,N-dimethyl-1,3-bis(oxidanylidene)-2-(3-oxidanyl-1H-quinolin-2-ylidene)indene-5-carboxamide
MOLECULAR FORMULA: C21H16N2O4
MOLECULAR WEIGHT: 360.36274
SMILES: CN(C)C(=O)C1=CC2=C(C=C1)C(=O)/C(=C/3\C(=CC4=CC=CC=C4N3)O)/C2=O
Structure:
CAS RN: 40618-31-3
CAS Name: (4E)-N-[2,5-dichloro-4-[[[(4Z)-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxo-2-naphthalenyl]-oxomethyl]amino]phenyl]-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxo-2-naphthalenecarboxamide
OPENEYE Name: (4E)-N-[2,5-dichloro-4-[[(4Z)-4-[(2,5-dichlorophenyl)hydrazono]-3-oxo-naphthalene-2-carbonyl]amino]phenyl]-4-[(2,5-dichlorophenyl)hydrazono]-3-oxo-naphthalene-2-carboxamide
IUPAC Name: (4E)-N-[2,5-dichloro-4-[[(4Z)-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]phenyl]-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxonaphthalene-2-carboxamide
SYSTEMATIC NAME: (4E)-4-[[2,5-bis(chloranyl)phenyl]hydrazinylidene]-N-[4-[[(4Z)-4-[[2,5-bis(chloranyl)phenyl]hydrazinylidene]-3-oxidanylidene-naphthalen-2-yl]carbonylamino]-2,5-bis(chloranyl)phenyl]-3-oxidanylidene-naphthalene-2-carboxamide
MOLECULAR FORMULA: C40H22Cl6N6O4
MOLECULAR WEIGHT: 863.35848
SMILES: C1=CC=C\2C(=C1)C=C(C(=O)/C2=N/NC3=C(C=CC(=C3)Cl)Cl)C(=O)NC4=CC(=C(C=C4Cl)NC(=O)C5=CC6=CC=CC=C6/C(=N/NC7=C(C=CC(=C7)Cl)Cl)/C5=O)Cl
Structure:
CAS RN: 790240-48-1
CAS Name: (4E)-N-[2,5-dichloro-4-[[[(4Z)-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxo-2-naphthalenyl]-oxomethyl]amino]phenyl]-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxo-2-naphthalenecarboxamide
OPENEYE Name: (4E)-N-[2,5-dichloro-4-[[(4Z)-4-[(2,5-dichlorophenyl)hydrazono]-3-oxo-naphthalene-2-carbonyl]amino]phenyl]-4-[(2,5-dichlorophenyl)hydrazono]-3-oxo-naphthalene-2-carboxamide
IUPAC Name: (4E)-N-[2,5-dichloro-4-[[(4Z)-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]phenyl]-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxonaphthalene-2-carboxamide
SYSTEMATIC NAME: (4E)-4-[[2,5-bis(chloranyl)phenyl]hydrazinylidene]-N-[4-[[(4Z)-4-[[2,5-bis(chloranyl)phenyl]hydrazinylidene]-3-oxidanylidene-naphthalen-2-yl]carbonylamino]-2,5-bis(chloranyl)phenyl]-3-oxidanylidene-naphthalene-2-carboxamide
MOLECULAR FORMULA: C40H22Cl6N6O4
MOLECULAR WEIGHT: 863.35848
SMILES: C1=CC=C\2C(=C1)C=C(C(=O)/C2=N/NC3=C(C=CC(=C3)Cl)Cl)C(=O)NC4=CC(=C(C=C4Cl)NC(=O)C5=CC6=CC=CC=C6/C(=N/NC7=C(C=CC(=C7)Cl)Cl)/C5=O)Cl
Structure:
CAS RN: 82643-43-4
CAS Name: (4E)-N-[2,5-dichloro-4-[[[(4Z)-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxo-2-naphthalenyl]-oxomethyl]amino]phenyl]-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxo-2-naphthalenecarboxamide
OPENEYE Name: (4E)-N-[2,5-dichloro-4-[[(4Z)-4-[(2,5-dichlorophenyl)hydrazono]-3-oxo-naphthalene-2-carbonyl]amino]phenyl]-4-[(2,5-dichlorophenyl)hydrazono]-3-oxo-naphthalene-2-carboxamide
IUPAC Name: (4E)-N-[2,5-dichloro-4-[[(4Z)-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxonaphthalene-2-carbonyl]amino]phenyl]-4-[(2,5-dichlorophenyl)hydrazinylidene]-3-oxonaphthalene-2-carboxamide
SYSTEMATIC NAME: (4E)-4-[[2,5-bis(chloranyl)phenyl]hydrazinylidene]-N-[4-[[(4Z)-4-[[2,5-bis(chloranyl)phenyl]hydrazinylidene]-3-oxidanylidene-naphthalen-2-yl]carbonylamino]-2,5-bis(chloranyl)phenyl]-3-oxidanylidene-naphthalene-2-carboxamide
MOLECULAR FORMULA: C40H22Cl6N6O4
MOLECULAR WEIGHT: 863.35848
SMILES: C1=CC=C\2C(=C1)C=C(C(=O)/C2=N/NC3=C(C=CC(=C3)Cl)Cl)C(=O)NC4=CC(=C(C=C4Cl)NC(=O)C5=CC6=CC=CC=C6/C(=N/NC7=C(C=CC(=C7)Cl)Cl)/C5=O)Cl
Structure:
CAS RN: 116084-01-6
CAS Name: 3-[(2Z)-5-chloro-2-[(2E)-2-[[5-chloro-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]-1-propanesulfonate; N,N-diethylethanamine
OPENEYE Name: 3-[(2Z)-5-chloro-2-[(2E)-2-[[5-chloro-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
IUPAC Name: 3-[(2Z)-5-chloro-2-[(2E)-2-[[5-chloro-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
SYSTEMATIC NAME: 3-[(2Z)-5-chloranyl-2-[(2E)-2-[[5-chloranyl-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
MOLECULAR FORMULA: C31H41Cl2N3O8S2
MOLECULAR WEIGHT: 718.70854
SMILES: CC/C(=C\C1=[N+](C2=C(O1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(O3)C=CC(=C4)Cl)CCCS(=O)(=O)[O-].CCN(CC)CC
Structure:
CAS RN: 143118-05-2
CAS Name: 3-[(2Z)-5-chloro-2-[(2E)-2-[[5-chloro-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]-1-propanesulfonate; N,N-diethylethanamine
OPENEYE Name: 3-[(2Z)-5-chloro-2-[(2E)-2-[[5-chloro-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
IUPAC Name: 3-[(2Z)-5-chloro-2-[(2E)-2-[[5-chloro-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
SYSTEMATIC NAME: 3-[(2Z)-5-chloranyl-2-[(2E)-2-[[5-chloranyl-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
MOLECULAR FORMULA: C31H41Cl2N3O8S2
MOLECULAR WEIGHT: 718.70854
SMILES: CC/C(=C\C1=[N+](C2=C(O1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(O3)C=CC(=C4)Cl)CCCS(=O)(=O)[O-].CCN(CC)CC
Structure:
CAS RN: 39201-42-8
CAS Name: 3-[(2Z)-5-chloro-2-[(2E)-2-[[5-chloro-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]-1-propanesulfonate; N,N-diethylethanamine
OPENEYE Name: 3-[(2Z)-5-chloro-2-[(2E)-2-[[5-chloro-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
IUPAC Name: 3-[(2Z)-5-chloro-2-[(2E)-2-[[5-chloro-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
SYSTEMATIC NAME: 3-[(2Z)-5-chloranyl-2-[(2E)-2-[[5-chloranyl-3-(3-sulfopropyl)-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate; N,N-diethylethanamine
MOLECULAR FORMULA: C31H41Cl2N3O8S2
MOLECULAR WEIGHT: 718.70854
SMILES: CC/C(=C\C1=[N+](C2=C(O1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(O3)C=CC(=C4)Cl)CCCS(=O)(=O)[O-].CCN(CC)CC
Structure:
No comments:
Post a Comment