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

Systemtic Name: methyl 8-[(2-methylphenyl)methyl]-5-oxidanylidene-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate Openeye Name: methyl 8-(o-tolylmethyl)-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate CAS Name: 8-[(2-methylphenyl)methyl]-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester IUPAC Name: methyl 8-[(2-methylphenyl)methyl]-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate Traditional Name: 7-amyl-5-keto-8-(2-methylbenzyl)-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(=O)C2=C(C1CC3=CC=CC=C3C)NC4=CC=CC(=C42)C(=O)OC

Isomeric SMILES

CCCCCC1CC(=O)C2=C(C1CC3=CC=CC=C3C)NC4=CC=CC(=C42)C(=O)OC

InChI

InChI=1S/C27H31NO3/c1-4-5-6-12-19-16-23(29)25-24-20(27(30)31-3)13-9-14-22(24)28-26(25)21(19)15-18-11-8-7-10-17(18)2/h7-11,13-14,19,21,28H,4-6,12,15-16H2,1-3H3