ethyl 3-[(3-chlorophenyl)methyl]-1-pyridin-4-ylcarbonyl-piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(3-chlorophenyl)methyl]-1-pyridin-4-ylcarbonyl-piperidine-3-carboxylate Openeye Name: ethyl 3-[(3-chlorophenyl)methyl]-1-(pyridine-4-carbonyl)piperidine-3-carboxylate CAS Name: 3-[(3-chlorophenyl)methyl]-1-[oxo(pyridin-4-yl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-chlorophenyl)methyl]-1-(pyridine-4-carbonyl)piperidine-3-carboxylate Traditional Name: 3-(3-chlorobenzyl)-1-isonicotinoyl-nipecotic acid ethyl ester Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=NC=C2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=NC=C2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN2O3/c1-2-27-20(26)21(14-16-5-3-6-18(22)13-16)9-4-12-24(15-21)19(25)17-7-10-23-11-8-17/h3,5-8,10-11,13H,2,4,9,12,14-15H2,1H3