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

Systemtic Name: (phenylmethyl) 9-(4-chlorophenyl)carbonyl-6-methoxy-1,2,3,4-tetrahydrocarbazole-3-carboxylate Openeye Name: benzyl 9-(4-chlorobenzoyl)-6-methoxy-1,2,3,4-tetrahydrocarbazole-3-carboxylate CAS Name: 9-[(4-chlorophenyl)-oxomethyl]-6-methoxy-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-(4-chlorobenzoyl)-6-methoxy-1,2,3,4-tetrahydrocarbazole-3-carboxylate Traditional Name: 9-(4-chlorobenzoyl)-6-methoxy-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid benzyl ester Formula: C28H24ClNO4 MolecularWeight: 473.94746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C3=C2CC(CC3)C(=O)OCC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=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/C28H24ClNO4/c1-33-22-12-14-26-24(16-22)23-15-20(28(32)34-17-18-5-3-2-4-6-18)9-13-25(23)30(26)27(31)19-7-10-21(29)11-8-19/h2-8,10-12,14,16,20H,9,13,15,17H2,1H3