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

Systemtic Name: (phenylmethyl) 9-(4-chlorophenyl)carbonyl-6-methyl-1,2,3,4-tetrahydrocarbazole-4-carboxylate Openeye Name: benzyl 9-(4-chlorobenzoyl)-6-methyl-1,2,3,4-tetrahydrocarbazole-4-carboxylate CAS Name: 9-[(4-chlorophenyl)-oxomethyl]-6-methyl-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-(4-chlorobenzoyl)-6-methyl-1,2,3,4-tetrahydrocarbazole-4-carboxylate Traditional Name: 9-(4-chlorobenzoyl)-6-methyl-1,2,3,4-tetrahydrocarbazole-4-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=C2C(CCC3)C(=O)OCC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2C(CCC3)C(=O)OCC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Cl

InChI

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