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

Systemtic Name: methyl 7-methyl-5-oxidanylidene-8-[[3-(phenylmethyl)phenyl]methyl]-6,7,8,9-tetrahydrocarbazole-4-carboxylate Openeye Name: methyl 8-[(3-benzylphenyl)methyl]-7-methyl-5-oxo-6,7,8,9-tetrahydrocarbazole-4-carboxylate CAS Name: 7-methyl-5-oxo-8-[[3-(phenylmethyl)phenyl]methyl]-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester IUPAC Name: methyl 8-[(3-benzylphenyl)methyl]-7-methyl-5-oxo-6,7,8,9-tetrahydrocarbazole-4-carboxylate Traditional Name: 8-(3-benzylbenzyl)-5-keto-7-methyl-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester Formula: C29H27NO3 MolecularWeight: 437.52958

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C1CC3=CC=CC(=C3)CC4=CC=CC=C4)NC5=CC=CC(=C52)C(=O)OC

Isomeric SMILES

CC1CC(=O)C2=C(C1CC3=CC=CC(=C3)CC4=CC=CC=C4)NC5=CC=CC(=C52)C(=O)OC

InChI

InChI=1S/C29H27NO3/c1-18-14-25(31)27-26-22(29(32)33-2)12-7-13-24(26)30-28(27)23(18)17-21-11-6-10-20(16-21)15-19-8-4-3-5-9-19/h3-13,16,18,23,30H,14-15,17H2,1-2H3