(2-chloranyl-5-methyl-phenyl) 1-(3,5-dimethoxyphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 1-(3,5-dimethoxyphenyl)carbonylpiperidine-4-carboxylate Openeye Name: (2-chloro-5-methyl-phenyl) 1-(3,5-dimethoxybenzoyl)piperidine-4-carboxylate CAS Name: 1-[(3,5-dimethoxyphenyl)-oxomethyl]-4-piperidinecarboxylic acid (2-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 1-(3,5-dimethoxybenzoyl)piperidine-4-carboxylate Traditional Name: 1-(3,5-dimethoxybenzoyl)isonipecotic acid (2-chloro-5-methyl-phenyl) ester Formula: C22H24ClNO5 MolecularWeight: 417.88266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(=O)C2CCN(CC2)C(=O)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC(=O)C2CCN(CC2)C(=O)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C22H24ClNO5/c1-14-4-5-19(23)20(10-14)29-22(26)15-6-8-24(9-7-15)21(25)16-11-17(27-2)13-18(12-16)28-3/h4-5,10-13,15H,6-9H2,1-3H3