ethyl 2-[(3-chlorophenyl)methyl]-5-oxidanyl-8-phenyl-1H-benzo[g]indole-3-carboxylate

Systemtic Name: ethyl 2-[(3-chlorophenyl)methyl]-5-oxidanyl-8-phenyl-1H-benzo[g]indole-3-carboxylate Openeye Name: ethyl 2-[(3-chlorophenyl)methyl]-5-hydroxy-8-phenyl-1H-benzo[g]indole-3-carboxylate CAS Name: 2-[(3-chlorophenyl)methyl]-5-hydroxy-8-phenyl-1H-benzo[g]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-chlorophenyl)methyl]-5-hydroxy-8-phenyl-1H-benzo[g]indole-3-carboxylate Traditional Name: 2-(3-chlorobenzyl)-5-hydroxy-8-phenyl-1H-benz[g]indole-3-carboxylic acid ethyl ester Formula: C28H22ClNO3 MolecularWeight: 455.93218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C3C=C(C=CC3=C(C=C12)O)C4=CC=CC=C4)CC5=CC(=CC=C5)Cl

Isomeric SMILES

CCOC(=O)C1=C(NC2=C3C=C(C=CC3=C(C=C12)O)C4=CC=CC=C4)CC5=CC(=CC=C5)Cl

InChI

InChI=1S/C28H22ClNO3/c1-2-33-28(32)26-23-16-25(31)21-12-11-19(18-8-4-3-5-9-18)15-22(21)27(23)30-24(26)14-17-7-6-10-20(29)13-17/h3-13,15-16,30-31H,2,14H2,1H3