methyl 5-oxidanylidene-7-pentyl-8-[[2-(phenylmethyl)phenyl]methyl]-6,7,8,9-tetrahydrocarbazole-4-carboxylate

Systemtic Name: methyl 5-oxidanylidene-7-pentyl-8-[[2-(phenylmethyl)phenyl]methyl]-6,7,8,9-tetrahydrocarbazole-4-carboxylate Openeye Name: methyl 8-[(2-benzylphenyl)methyl]-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate CAS Name: 5-oxo-7-pentyl-8-[[2-(phenylmethyl)phenyl]methyl]-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester IUPAC Name: methyl 8-[(2-benzylphenyl)methyl]-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate Traditional Name: 7-amyl-8-(2-benzylbenzyl)-5-keto-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester Formula: C33H35NO3 MolecularWeight: 493.6359

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(=O)C2=C(C1CC3=CC=CC=C3CC4=CC=CC=C4)NC5=CC=CC(=C52)C(=O)OC

Isomeric SMILES

CCCCCC1CC(=O)C2=C(C1CC3=CC=CC=C3CC4=CC=CC=C4)NC5=CC=CC(=C52)C(=O)OC

InChI

InChI=1S/C33H35NO3/c1-3-4-6-16-25-21-29(35)31-30-26(33(36)37-2)17-11-18-28(30)34-32(31)27(25)20-24-15-10-9-14-23(24)19-22-12-7-5-8-13-22/h5,7-15,17-18,25,27,34H,3-4,6,16,19-21H2,1-2H3