ethyl 3-[(3-chlorophenyl)methyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(3-chlorophenyl)methyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxylate Openeye Name: ethyl 3-[(3-chlorophenyl)methyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxylate CAS Name: 3-[(3-chlorophenyl)methyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-chlorophenyl)methyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxylate Traditional Name: 3-(3-chlorobenzyl)-1-(2-thenoyl)nipecotic acid ethyl ester Formula: C20H22ClNO3S MolecularWeight: 391.91158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=CS2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=CS2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClNO3S/c1-2-25-19(24)20(13-15-6-3-7-16(21)12-15)9-5-10-22(14-20)18(23)17-8-4-11-26-17/h3-4,6-8,11-12H,2,5,9-10,13-14H2,1H3