methyl 5-[(3,5-dimethoxyphenyl)methyl]-2-oxidanyl-6-oxidanylidene-11H-benzo[b]carbazole-1-carboxylate

Systemtic Name: methyl 5-[(3,5-dimethoxyphenyl)methyl]-2-oxidanyl-6-oxidanylidene-11H-benzo[b]carbazole-1-carboxylate Openeye Name: methyl 5-[(3,5-dimethoxyphenyl)methyl]-2-hydroxy-6-oxo-11H-benzo[b]carbazole-1-carboxylate CAS Name: 5-[(3,5-dimethoxyphenyl)methyl]-2-hydroxy-6-oxo-11H-benzo[b]carbazole-1-carboxylic acid methyl ester IUPAC Name: methyl 5-[(3,5-dimethoxyphenyl)methyl]-2-hydroxy-6-oxo-11H-benzo[b]carbazole-1-carboxylate Traditional Name: 5-(3,5-dimethoxybenzyl)-2-hydroxy-6-keto-11H-benzo[b]carbazole-1-carboxylic acid methyl ester Formula: C27H23NO6 MolecularWeight: 457.47462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CN2C3=C(C4=C2C(=O)C5=CC=CC=C5C4)C(=C(C=C3)O)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CN2C3=C(C4=C2C(=O)C5=CC=CC=C5C4)C(=C(C=C3)O)C(=O)OC)OC

InChI

InChI=1S/C27H23NO6/c1-32-17-10-15(11-18(13-17)33-2)14-28-21-8-9-22(29)24(27(31)34-3)23(21)20-12-16-6-4-5-7-19(16)26(30)25(20)28/h4-11,13,29H,12,14H2,1-3H3