CAS RN: 73296-87-4
CAS Name: 2-(chloromethyl)oxirane; 2-[(2-hydroxyphenyl)methyl]phenol; 2-propenoic acid
OPENEYE Name: acrylic acid; 2-(chloromethyl)oxirane; 2-[(2-hydroxyphenyl)methyl]phenol
IUPAC Name: 2-(chloromethyl)oxirane; 2-[(2-hydroxyphenyl)methyl]phenol; prop-2-enoic acid
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 2-[(2-hydroxyphenyl)methyl]phenol; prop-2-enoic acid
MOLECULAR FORMULA: C22H25ClO7
MOLECULAR WEIGHT: 436.8827
SMILES: C=CC(=O)O.C=CC(=O)O.C1C(O1)CCl.C1=CC=C(C(=C1)CC2=CC=CC=C2O)O
CAS RN: 98143-50-1
CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; docosyl dihydrogen phosphate
OPENEYE Name: 2-[bis(2-hydroxyethyl)amino]ethanol; docosyl dihydrogen phosphate
IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; docosyl dihydrogen phosphate
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)amino]ethanol; docosyl dihydrogen phosphate
MOLECULAR FORMULA: C28H62NO7P
MOLECULAR WEIGHT: 555.768141
SMILES: CCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)O.C(CO)N(CCO)CCO
CAS RN: 72089-09-9
CAS Name: sodium 18-phenyloctadecanoate
OPENEYE Name: sodium 18-phenyloctadecanoate
IUPAC Name: sodium 18-phenyloctadecanoate
SYSTEMATIC NAME: sodium 18-phenyloctadecanoate
MOLECULAR FORMULA: C24H39NaO2
MOLECULAR WEIGHT: 382.55503
SMILES: C1=CC=C(C=C1)CCCCCCCCCCCCCCCCCC(=O)[O-].[Na+]
CAS RN: 18360-25-3
CAS Name: sodium 3-[(2E)-5-chloro-2-[(2Z)-2-[[5-chloro-3-(3-sulfonatopropyl)-3a,4-dihydro-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]-1-propanesulfonate
OPENEYE Name: sodium 3-[(2E)-5-chloro-2-[(2Z)-2-[[5-chloro-3-(3-sulfonatopropyl)-3a,4-dihydro-1,3-benzoxazol-3-ium-2-yl]methylene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate
IUPAC Name: sodium 3-[(2E)-5-chloro-2-[(2Z)-2-[[5-chloro-3-(3-sulfonatopropyl)-3a,4-dihydro-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: sodium 3-[(2E)-5-chloranyl-2-[(2Z)-2-[[5-chloranyl-3-(3-sulfonatopropyl)-3a,4-dihydro-1,3-benzoxazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C25H27Cl2N2NaO8S2
MOLECULAR WEIGHT: 641.51625
SMILES: CC/C(=C/C1=[N+](C2CC(=CC=C2O1)Cl)CCCS(=O)(=O)[O-])/C=C/3\N(C4=C(O3)C=CC(=C4)Cl)CCCS(=O)(=O)[O-].[Na+]
CAS RN: 72791-01-6
CAS Name: N'-(2-chloro-4-nitrophenyl)-2,2-dimethylpropanehydrazide
OPENEYE Name: N'-(2-chloro-4-nitro-phenyl)-2,2-dimethyl-propanehydrazide
IUPAC Name: N'-(2-chloro-4-nitrophenyl)-2,2-dimethylpropanehydrazide
SYSTEMATIC NAME: N'-(2-chloranyl-4-nitro-phenyl)-2,2-dimethyl-propanehydrazide
MOLECULAR FORMULA: C11H14ClN3O3
MOLECULAR WEIGHT: 271.70016
SMILES: CC(C)(C)C(=O)NNC1=C(C=C(C=C1)[N+](=O)[O-])Cl
CAS RN: 94278-19-0
CAS Name: 2-[1-(2-furanylmethoxy)propoxymethyl]furan
OPENEYE Name: 2-[1-(2-furylmethoxy)propoxymethyl]furan
IUPAC Name: 2-[1-(furan-2-ylmethoxy)propoxymethyl]furan
SYSTEMATIC NAME: 2-[1-(furan-2-ylmethoxy)propoxymethyl]furan
MOLECULAR FORMULA: C13H16O4
MOLECULAR WEIGHT: 236.26374
SMILES: CCC(OCC1=CC=CO1)OCC2=CC=CO2
CAS RN: 69984-26-5
CAS Name: 5-methyl-1-phenyl-1,3,4,6-tetrahydro-2,5-benzoxazocine hydrobromide
OPENEYE Name: 5-methyl-1-phenyl-1,3,4,6-tetrahydro-2,5-benzoxazocine hydrobromide
IUPAC Name: 5-methyl-1-phenyl-1,3,4,6-tetrahydro-2,5-benzoxazocine hydrobromide
SYSTEMATIC NAME: 5-methyl-1-phenyl-1,3,4,6-tetrahydro-2,5-benzoxazocine hydrobromide
MOLECULAR FORMULA: C17H20BrNO
MOLECULAR WEIGHT: 334.2508
SMILES: CN1CCOC(C2=CC=CC=C2C1)C3=CC=CC=C3.Br
CAS RN: 153235-89-3
CAS Name: (2S)-5-amino-2-[(2-butoxy-1-oxoethyl)amino]-5-oxopentanoic acid
OPENEYE Name: (2S)-5-amino-2-[(2-butoxyacetyl)amino]-5-oxo-pentanoic acid
IUPAC Name: (2S)-5-amino-2-[(2-butoxyacetyl)amino]-5-oxopentanoic acid
SYSTEMATIC NAME: (2S)-5-azanyl-2-(2-butoxyethanoylamino)-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C11H20N2O5
MOLECULAR WEIGHT: 260.2869
SMILES: CCCCOCC(=O)N[C@@H](CCC(=O)N)C(=O)O
CAS RN: 93857-84-2
CAS Name: 4-[(2Z)-2-[[(5E)-5-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-4-oxo-3-prop-2-enyl-2-thiazol-3-iumyl]methylidene]-4,5-diphenyl-3-thiazolyl]-1-butanesulfonate
OPENEYE Name: 4-[(2Z)-2-[[(5E)-3-allyl-5-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-4-oxo-thiazol-3-ium-2-yl]methylene]-4,5-diphenyl-thiazol-3-yl]butane-1-sulfonate
IUPAC Name: 4-[(2Z)-2-[[(5E)-5-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-4-oxo-3-prop-2-enyl-1,3-thiazol-3-ium-2-yl]methylidene]-4,5-diphenyl-1,3-thiazol-3-yl]butane-1-sulfonate
SYSTEMATIC NAME: 4-[(2Z)-2-[[(5E)-5-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-4-oxidanylidene-3-prop-2-enyl-1,3-thiazol-3-ium-2-yl]methylidene]-4,5-diphenyl-1,3-thiazol-3-yl]butane-1-sulfonate
MOLECULAR FORMULA: C37H35N3O4S4
MOLECULAR WEIGHT: 713.9515
SMILES: CCN\1C2=CC=CC=C2S/C1=C\C=C\3/C(=O)[N+](=C(S3)/C=C\4/N(C(=C(S4)C5=CC=CC=C5)C6=CC=CC=C6)CCCCS(=O)(=O)[O-])CC=C
CAS RN: 84145-81-3
CAS Name: dimethyl-[7-(methylamino)-3-phenothiazinylidene]ammonium; tetraphenylboranuide
OPENEYE Name: dimethyl-[7-(methylamino)phenothiazin-3-ylidene]ammonium; tetraphenylboranuide
IUPAC Name: dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium; tetraphenylboranuide
SYSTEMATIC NAME: dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium; tetraphenylboranuide
MOLECULAR FORMULA: C39H36BN3S
MOLECULAR WEIGHT: 589.59924
SMILES: [B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2
CAS RN: 83918-77-8
CAS Name: 2-[4-[2-hydroxy-3-[[3-[3-[4-(1-methylethenyl)-2-oxo-3H-benzimidazol-1-yl]propyl]phenyl]methylamino]propoxy]phenyl]acetic acid methyl ester
OPENEYE Name: methyl 2-[4-[2-hydroxy-3-[[3-[3-(4-isopropenyl-2-oxo-3H-benzimidazol-1-yl)propyl]phenyl]methylamino]propoxy]phenyl]acetate
IUPAC Name: methyl 2-[4-[2-hydroxy-3-[[3-[3-(2-oxo-4-prop-1-en-2-yl-3H-benzimidazol-1-yl)propyl]phenyl]methylamino]propoxy]phenyl]acetate
SYSTEMATIC NAME: methyl 2-[4-[2-oxidanyl-3-[[3-[3-(2-oxidanylidene-4-prop-1-en-2-yl-3H-benzimidazol-1-yl)propyl]phenyl]methylamino]propoxy]phenyl]ethanoate
MOLECULAR FORMULA: C32H37N3O5
MOLECULAR WEIGHT: 543.65328
SMILES: CC(=C)C1=C2C(=CC=C1)N(C(=O)N2)CCCC3=CC(=CC=C3)CNCC(COC4=CC=C(C=C4)CC(=O)OC)O
CAS RN: 110897-64-8
CAS Name: ammonium; 2-methyl-2-(1-oxoprop-2-enylamino)-1-propanesulfonate; 2-propenamide
OPENEYE Name: ammonium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; prop-2-enamide
IUPAC Name: azanium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; prop-2-enamide
SYSTEMATIC NAME: azanium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; prop-2-enamide
MOLECULAR FORMULA: C10H21N3O5S
MOLECULAR WEIGHT: 295.35584
SMILES: CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.C=CC(=O)N.[NH4+]
CAS RN: 356057-15-3
CAS Name: ammonium; 2-methyl-2-(1-oxoprop-2-enylamino)-1-propanesulfonate; 2-propenamide
OPENEYE Name: ammonium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; prop-2-enamide
IUPAC Name: azanium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; prop-2-enamide
SYSTEMATIC NAME: azanium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; prop-2-enamide
MOLECULAR FORMULA: C10H21N3O5S
MOLECULAR WEIGHT: 295.35584
SMILES: CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.C=CC(=O)N.[NH4+]
CAS RN: 11125-96-5
CAS Name: copper disodium carbonate sulfate
OPENEYE Name: copper disodium carbonate sulfate
IUPAC Name: copper disodium carbonate sulfate
SYSTEMATIC NAME: copper disodium carbonate sulfate
MOLECULAR FORMULA: CCuNa2O7S
MOLECULAR WEIGHT: 265.59704
SMILES: C(=O)([O-])[O-].[O-]S(=O)(=O)[O-].[Na+].[Na+].[Cu+2]
CAS RN: 83721-56-6
CAS Name: 4-chloro-N-[5-[[(4-chlorophenyl)-oxomethyl]amino]-4,8-dihydroxy-9,10-dioxo-1-anthracenyl]benzamide
OPENEYE Name: 4-chloro-N-[5-[(4-chlorobenzoyl)amino]-4,8-dihydroxy-9,10-dioxo-1-anthryl]benzamide
IUPAC Name: 4-chloro-N-[5-[(4-chlorobenzoyl)amino]-4,8-dihydroxy-9,10-dioxoanthracen-1-yl]benzamide
SYSTEMATIC NAME: 4-chloranyl-N-[5-[(4-chlorophenyl)carbonylamino]-4,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-1-yl]benzamide
MOLECULAR FORMULA: C28H16Cl2N2O6
MOLECULAR WEIGHT: 547.34244
SMILES: C1=CC(=CC=C1C(=O)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NC(=O)C5=CC=C(C=C5)Cl)Cl
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