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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC2=C(C(=O)C1)C3=C(C=CC=C3N2CC4=CC=CC=C4C)C(=O)OC

Isomeric SMILES

CCCCCC1CC2=C(C(=O)C1)C3=C(C=CC=C3N2CC4=CC=CC=C4C)C(=O)OC

InChI

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