(3,5-dimethoxyphenyl) 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (3,5-dimethoxyphenyl) 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: (3,5-dimethoxyphenyl) 1-(4-chlorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-4-piperidinecarboxylic acid (3,5-dimethoxyphenyl) ester IUPAC Name: (3,5-dimethoxyphenyl) 1-(4-chlorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-chlorobenzoyl)isonipecotic acid (3,5-dimethoxyphenyl) ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)OC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)OC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C21H22ClNO5/c1-26-17-11-18(27-2)13-19(12-17)28-21(25)15-7-9-23(10-8-15)20(24)14-3-5-16(22)6-4-14/h3-6,11-13,15H,7-10H2,1-2H3