(phenylmethyl) 9-(4-chlorophenyl)carbonyl-6-methyl-1,2,3,4-tetrahydrocarbazole-3-carboxylate

Systemtic Name: (phenylmethyl) 9-(4-chlorophenyl)carbonyl-6-methyl-1,2,3,4-tetrahydrocarbazole-3-carboxylate Openeye Name: benzyl 9-(4-chlorobenzoyl)-6-methyl-1,2,3,4-tetrahydrocarbazole-3-carboxylate CAS Name: 9-[(4-chlorophenyl)-oxomethyl]-6-methyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-(4-chlorobenzoyl)-6-methyl-1,2,3,4-tetrahydrocarbazole-3-carboxylate Traditional Name: 9-(4-chlorobenzoyl)-6-methyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid benzyl ester Formula: C28H24ClNO3 MolecularWeight: 457.94806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2CC(CC3)C(=O)OCC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2CC(CC3)C(=O)OCC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H24ClNO3/c1-18-7-13-25-23(15-18)24-16-21(28(32)33-17-19-5-3-2-4-6-19)10-14-26(24)30(25)27(31)20-8-11-22(29)12-9-20/h2-9,11-13,15,21H,10,14,16-17H2,1H3