CAS RN: 34219-40-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C40H51N5O11
MOLECULAR WEIGHT: 777.85984
SMILES: CC1/C=C\C=C(/C(=O)N=C2C=C(C3=C4C(=C(C(=C3C2=O)O)C)OC(C4=O)(O/C=C\C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)NNC5=NCCN5)\C
Structure:
CAS RN: 34219-38-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C40H53N5O12
MOLECULAR WEIGHT: 795.87512
SMILES: CC1/C=C\C=C(/C(=O)N=C2C=C(C3=C4C(=C(C(=C3C2=O)O)C)OC(C4=O)(O/C=C\C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)NNC(=NCCO)N)\C
Structure:
CAS RN: 38330-14-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C43H59N4O13+
MOLECULAR WEIGHT: 839.94756
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NNC(=O)C[N+](C)(C)C)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 13440-42-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C45H53N3O12
MOLECULAR WEIGHT: 827.91522
SMILES: CC1/C=C\C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C/N/N=C/C5=CC=CC=C5)C(=O)C(O4)(O/C=C\C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 13292-26-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C45H54N2O12
MOLECULAR WEIGHT: 814.91646
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NC5=CC=C(C=C5)C)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 13292-49-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C40H49N5O12
MOLECULAR WEIGHT: 791.84336
SMILES: CC1/C=C\C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C/NN5C=NN=C5)C(=O)C(O4)(O/C=C\C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 13292-27-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C44H51ClN2O12
MOLECULAR WEIGHT: 835.33494
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NC5=CC=C(C=C5)Cl)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 60948-24-5
CAS Name: N-[[4-(9-azaspiro[5.5]undecan-9-yl)phenyl]methylideneamino]benzamide hydrochloride
OPENEYE Name: N-[[4-(9-azaspiro[5.5]undecan-9-yl)phenyl]methyleneamino]benzamide hydrochloride
IUPAC Name: N-[[4-(9-azaspiro[5.5]undecan-9-yl)phenyl]methylideneamino]benzamide hydrochloride
SYSTEMATIC NAME: N-[[4-(9-azaspiro[5.5]undecan-9-yl)phenyl]methylideneamino]benzamide hydrochloride
MOLECULAR FORMULA: C24H30ClN3O
MOLECULAR WEIGHT: 411.9675
SMILES: C1CCC2(CC1)CCN(CC2)C3=CC=C(C=C3)C=NNC(=O)C4=CC=CC=C4.Cl
Structure:
CAS RN: 38942-72-2
CAS Name: 7-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-6,9,11-trihydroxy-4-methoxy-9-[(1Z)-1-methoxyiminoethyl]-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
OPENEYE Name: 7-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-6,9,11-trihydroxy-4-methoxy-9-[(Z)-N-methoxy-C-methyl-carbonimidoyl]-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
IUPAC Name: 7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-4-methoxy-9-[(Z)-N-methoxy-C-methylcarbonimidoyl]-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
SYSTEMATIC NAME: 7-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-4-methoxy-9-[(Z)-N-methoxy-C-methyl-carbonimidoyl]-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
MOLECULAR FORMULA: C28H33ClN2O10
MOLECULAR WEIGHT: 593.02202
SMILES: CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(/C(=N\OC)/C)O)N)O.Cl
Structure:
CAS RN: 51867-88-0
CAS Name: 6-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-7-ol; sodium
OPENEYE Name: 6-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol; sodium
IUPAC Name: 6-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol; sodium
SYSTEMATIC NAME: 6-(6-aminopurin-9-yl)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol; sodium
MOLECULAR FORMULA: C10H12N5NaO6P
MOLECULAR WEIGHT: 352.195711
SMILES: C1C2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)OP(=O)(O1)O.[Na]
Structure:
CAS RN: 35687-08-2
CAS Name: 4-tert-butyl-2-[[methyl(octyl)amino]methyl]-6-phenylphenol hydrochloride
OPENEYE Name: 4-tert-butyl-2-[[methyl(octyl)amino]methyl]-6-phenyl-phenol hydrochloride
IUPAC Name: 4-tert-butyl-2-[[methyl(octyl)amino]methyl]-6-phenylphenol hydrochloride
SYSTEMATIC NAME: 4-tert-butyl-2-[[methyl(octyl)amino]methyl]-6-phenyl-phenol hydrochloride
MOLECULAR FORMULA: C26H40ClNO
MOLECULAR WEIGHT: 418.0549
SMILES: CCCCCCCCN(C)CC1=C(C(=CC(=C1)C(C)(C)C)C2=CC=CC=C2)O.Cl
Structure:
CAS RN: 69998-58-9
CAS Name: sodium; 2,3,5,6-tetramethylbenzenesulfonic acid
OPENEYE Name: sodium; 2,3,5,6-tetramethylbenzenesulfonic acid
IUPAC Name: sodium; 2,3,5,6-tetramethylbenzenesulfonic acid
SYSTEMATIC NAME: sodium; 2,3,5,6-tetramethylbenzenesulfonic acid
MOLECULAR FORMULA: C10H14NaO3S
MOLECULAR WEIGHT: 237.27113
SMILES: CC1=CC(=C(C(=C1C)S(=O)(=O)O)C)C.[Na]
Structure:
CAS RN: 47814-20-0
CAS Name: 1,1,1,5,5,5-hexafluoropentane-2,4-dione; praseodymium
OPENEYE Name: 1,1,1,5,5,5-hexafluoropentane-2,4-dione; praseodymium
IUPAC Name: 1,1,1,5,5,5-hexafluoropentane-2,4-dione; praseodymium
SYSTEMATIC NAME: 1,1,1,5,5,5-hexakis(fluoranyl)pentane-2,4-dione; praseodymium
MOLECULAR FORMULA: C15H6F18O6Pr
MOLECULAR WEIGHT: 765.083448
SMILES: C(C(=O)C(F)(F)F)C(=O)C(F)(F)F.C(C(=O)C(F)(F)F)C(=O)C(F)(F)F.C(C(=O)C(F)(F)F)C(=O)C(F)(F)F.[Pr]
Structure:
CAS RN: 34610-60-1
CAS Name: (7S,9S)-7-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-6,9,11-trihydroxy-9-[(1E)-1-hydroxyiminoethyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
OPENEYE Name: (7S,9S)-7-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-6,9,11-trihydroxy-9-[(E)-N-hydroxy-C-methyl-carbonimidoyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
IUPAC Name: (7S,9S)-7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-9-[(E)-N-hydroxy-C-methylcarbonimidoyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
SYSTEMATIC NAME: (7S,9S)-7-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-4-methoxy-9-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
MOLECULAR FORMULA: C27H31ClN2O10
MOLECULAR WEIGHT: 578.99544
SMILES: CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(/C(=N/O)/C)O)N)O.Cl
Structure:
CAS RN: 35676-77-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C51H66N4O12
MOLECULAR WEIGHT: 927.08934
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NN5CCN(CC5)CCCC6=CC=CC=C6)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 38136-09-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C43H57N3O12
MOLECULAR WEIGHT: 807.92558
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NNC5CCCC5)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 38136-03-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C45H61N3O12
MOLECULAR WEIGHT: 835.97874
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NNC5CCCCCC5)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 35831-76-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C50H64N4O12
MOLECULAR WEIGHT: 913.06276
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NN5CCN(CC5)CCC6=CC=CC=C6)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 37107-25-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C45H62N4O12
MOLECULAR WEIGHT: 850.99338
SMILES: CCCN1CCN(CC1)N/C=C\2/C3=C(C4=C(C(=C5C(=C4C2=O)C(=O)C(O5)(O/C=C/C(C(C(C(C(C(C(C(/C=C/C=C(/C(=O)N3)\C)C)O)C)O)C)OC(=O)C)C)OC)C)C)O)O
Structure:
CAS RN: 37392-57-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C44H60N4O12
MOLECULAR WEIGHT: 836.9668
SMILES: CCN1CCN(CC1)N/C=C\2/C3=C(C4=C(C(=C5C(=C4C2=O)C(=O)C(O5)(O/C=C/C(C(C(C(C(C(C(C(/C=C/C=C(/C(=O)N3)\C)C)O)C)O)C)OC(=O)C)C)OC)C)C)O)O
Structure:
CAS RN: 38136-10-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C44H59N3O12
MOLECULAR WEIGHT: 821.95216
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NNC5CCCCC5)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 38128-83-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C42H56N2O13
MOLECULAR WEIGHT: 796.89964
SMILES: CCCCON/C=C/1\C2=C(C3=C(C(=C4C(=C3C1=O)C(=O)C(O4)(O/C=C\C(C(C(C(C(C(C(C(/C=C\C=C(/C(=O)N2)\C)C)O)C)O)C)OC(=O)C)C)OC)C)C)O)O
Structure:
CAS RN: 38128-92-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C41H54N2O13
MOLECULAR WEIGHT: 782.87306
SMILES: CC1/C=C\C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C/NOC(C)C)C(=O)C(O4)(O/C=C\C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 38128-86-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C46H56N2O13
MOLECULAR WEIGHT: 844.94244
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NOCCC5=CC=CC=C5)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 13456-01-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C45H54N2O13
MOLECULAR WEIGHT: 830.91586
SMILES: CC1/C=C\C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C/NOCC5=CC=CC=C5)C(=O)C(O4)(O/C=C\C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 13292-36-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C44H61N3O12
MOLECULAR WEIGHT: 823.96804
SMILES: CCCN(CCC)N/C=C\1/C2=C(C3=C(C(=C4C(=C3C1=O)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C(C(/C=C/C=C(/C(=O)N2)\C)C)O)C)O)C)OC(=O)C)C)OC)C)C)O)O
Structure:
CAS RN: 3206-15-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C43H58N2NaO13
MOLECULAR WEIGHT: 833.91599
SMILES: CCN(CC)C(=O)COC1=C2C3=C(C(=C1)NC(=O)/C(=C/C=C/C(C(C(C(C(C(C(C(/C=C/OC4(C(=O)C2=C(O4)C(=C3O)C)C)OC)C)OC(=O)C)C)O)C)O)C)/C)O.[Na]
Structure:
CAS RN: 25957-39-5
CAS Name: 3-phenyl-2-oxiranecarboxylic acid; sodium
OPENEYE Name: 3-phenyloxirane-2-carboxylic acid; sodium
IUPAC Name: 3-phenyloxirane-2-carboxylic acid; sodium
SYSTEMATIC NAME: 3-phenyloxirane-2-carboxylic acid; sodium
MOLECULAR FORMULA: C9H8NaO3
MOLECULAR WEIGHT: 187.14779
SMILES: C1=CC=C(C=C1)C2C(O2)C(=O)O.[Na]
Structure:
CAS RN: 57545-81-0
CAS Name: butanedioic acid; silver
OPENEYE Name: silver; succinic acid
IUPAC Name: butanedioic acid; silver
SYSTEMATIC NAME: butanedioic acid; silver
MOLECULAR FORMULA: C4H6AgO4
MOLECULAR WEIGHT: 225.95624
SMILES: C(CC(=O)O)C(=O)O.[Ag]
Structure:
CAS RN: 72247-99-5
CAS Name: 2-nitrobenzoic acid; silver
OPENEYE Name: 2-nitrobenzoic acid; silver
IUPAC Name: 2-nitrobenzoic acid; silver
SYSTEMATIC NAME: 2-nitrobenzoic acid; silver
MOLECULAR FORMULA: C7H5AgNO4
MOLECULAR WEIGHT: 274.9871
SMILES: C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-].[Ag]
Structure:
CAS RN: 41468-10-4
CAS Name: hydroxy-(4-methylphenyl)methanesulfonic acid; sodium
OPENEYE Name: hydroxy(p-tolyl)methanesulfonic acid; sodium
IUPAC Name: hydroxy-(4-methylphenyl)methanesulfonic acid; sodium
SYSTEMATIC NAME: (4-methylphenyl)-oxidanyl-methanesulfonic acid; sodium
MOLECULAR FORMULA: C8H10NaO4S
MOLECULAR WEIGHT: 225.21737
SMILES: CC1=CC=C(C=C1)C(O)S(=O)(=O)O.[Na]
Structure:
CAS RN: 10360-31-3
CAS Name: 2-[2-(4-aminophenyl)-1,3-benzothiazol-6-yl]-6-methyl-1,3-benzothiazole-7-sulfonic acid; sodium
OPENEYE Name: 2-[2-(4-aminophenyl)-1,3-benzothiazol-6-yl]-6-methyl-1,3-benzothiazole-7-sulfonic acid; sodium
IUPAC Name: 2-[2-(4-aminophenyl)-1,3-benzothiazol-6-yl]-6-methyl-1,3-benzothiazole-7-sulfonic acid; sodium
SYSTEMATIC NAME: 2-[2-(4-aminophenyl)-1,3-benzothiazol-6-yl]-6-methyl-1,3-benzothiazole-7-sulfonic acid; sodium
MOLECULAR FORMULA: C21H15N3NaO3S3
MOLECULAR WEIGHT: 476.54687
SMILES: CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(S4)C5=CC=C(C=C5)N)S(=O)(=O)O.[Na]
Structure:
CAS RN: 53366-09-9
CAS Name: 7-methoxy-2-methylisoquinolin-2-ium iodide
OPENEYE Name: 7-methoxy-2-methyl-isoquinolin-2-ium iodide
IUPAC Name: 7-methoxy-2-methylisoquinolin-2-ium iodide
SYSTEMATIC NAME: 7-methoxy-2-methyl-isoquinolin-2-ium iodide
MOLECULAR FORMULA: C11H12INO
MOLECULAR WEIGHT: 301.12355
SMILES: C[N+]1=CC2=C(C=CC(=C2)OC)C=C1.[I-]
Structure:
CAS RN: 10172-01-7
CAS Name: 2,3,10,11-tetramethoxy-8-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium iodide
OPENEYE Name: 2,3,10,11-tetramethoxy-8-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium iodide
IUPAC Name: 2,3,10,11-tetramethoxy-8-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium iodide
SYSTEMATIC NAME: 2,3,10,11-tetramethoxy-8-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium iodide
MOLECULAR FORMULA: C22H24INO4
MOLECULAR WEIGHT: 493.33473
SMILES: CC1=[N+]2CCC3=CC(=C(C=C3C2=CC4=CC(=C(C=C14)OC)OC)OC)OC.[I-]
Structure:
CAS RN: 17366-49-3
CAS Name: 8-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium iodide
OPENEYE Name: 8-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium iodide
IUPAC Name: 8-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium iodide
SYSTEMATIC NAME: 8-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium iodide
MOLECULAR FORMULA: C18H16IN
MOLECULAR WEIGHT: 373.23081
SMILES: CC1=[N+]2CCC3=CC=CC=C3C2=CC4=CC=CC=C14.[I-]
Structure:
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