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

Systemtic Name: methyl 8-[(3-methylphenyl)methyl]-5-oxidanylidene-6,7,8,9-tetrahydrocarbazole-4-carboxylate Openeye Name: methyl 8-(m-tolylmethyl)-5-oxo-6,7,8,9-tetrahydrocarbazole-4-carboxylate CAS Name: 8-[(3-methylphenyl)methyl]-5-oxo-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester IUPAC Name: methyl 8-[(3-methylphenyl)methyl]-5-oxo-6,7,8,9-tetrahydrocarbazole-4-carboxylate Traditional Name: 5-keto-8-(3-methylbenzyl)-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester Formula: C22H21NO3 MolecularWeight: 347.40704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2CCC(=O)C3=C2NC4=CC=CC(=C43)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)CC2CCC(=O)C3=C2NC4=CC=CC(=C43)C(=O)OC

InChI

InChI=1S/C22H21NO3/c1-13-5-3-6-14(11-13)12-15-9-10-18(24)20-19-16(22(25)26-2)7-4-8-17(19)23-21(15)20/h3-8,11,15,23H,9-10,12H2,1-2H3