methyl 5-oxidanylidene-7-pentyl-8-[[3-(phenylmethyl)phenyl]methyl]-6,7,8,9-tetrahydrocarbazole-4-carboxylate

Systemtic Name: methyl 5-oxidanylidene-7-pentyl-8-[[3-(phenylmethyl)phenyl]methyl]-6,7,8,9-tetrahydrocarbazole-4-carboxylate Openeye Name: methyl 8-[(3-benzylphenyl)methyl]-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate CAS Name: 5-oxo-7-pentyl-8-[[3-(phenylmethyl)phenyl]methyl]-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester IUPAC Name: methyl 8-[(3-benzylphenyl)methyl]-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate Traditional Name: 7-amyl-8-(3-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(=C3)CC4=CC=CC=C4)NC5=CC=CC(=C52)C(=O)OC

Isomeric SMILES

CCCCCC1CC(=O)C2=C(C1CC3=CC=CC(=C3)CC4=CC=CC=C4)NC5=CC=CC(=C52)C(=O)OC

InChI

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