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

Systemtic Name: methyl 8-[(3-bromophenyl)methyl]-7-methyl-5-oxidanylidene-6,7,8,9-tetrahydrocarbazole-4-carboxylate Openeye Name: methyl 8-[(3-bromophenyl)methyl]-7-methyl-5-oxo-6,7,8,9-tetrahydrocarbazole-4-carboxylate CAS Name: 8-[(3-bromophenyl)methyl]-7-methyl-5-oxo-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester IUPAC Name: methyl 8-[(3-bromophenyl)methyl]-7-methyl-5-oxo-6,7,8,9-tetrahydrocarbazole-4-carboxylate Traditional Name: 8-(3-bromobenzyl)-5-keto-7-methyl-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester Formula: C22H20BrNO3 MolecularWeight: 426.3031

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C1CC3=CC(=CC=C3)Br)NC4=CC=CC(=C42)C(=O)OC

Isomeric SMILES

CC1CC(=O)C2=C(C1CC3=CC(=CC=C3)Br)NC4=CC=CC(=C42)C(=O)OC

InChI

InChI=1S/C22H20BrNO3/c1-12-9-18(25)20-19-15(22(26)27-2)7-4-8-17(19)24-21(20)16(12)11-13-5-3-6-14(23)10-13/h3-8,10,12,16,24H,9,11H2,1-2H3