ethyl 4-[(2-chlorophenyl)methyl]-1-thiophen-3-ylcarbonyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(2-chlorophenyl)methyl]-1-thiophen-3-ylcarbonyl-piperidine-4-carboxylate Openeye Name: ethyl 4-[(2-chlorophenyl)methyl]-1-(thiophene-3-carbonyl)piperidine-4-carboxylate CAS Name: 4-[(2-chlorophenyl)methyl]-1-[oxo(3-thiophenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-chlorophenyl)methyl]-1-(thiophene-3-carbonyl)piperidine-4-carboxylate Traditional Name: 4-(2-chlorobenzyl)-1-(3-thenoyl)isonipecotic acid ethyl ester Formula: C20H22ClNO3S MolecularWeight: 391.91158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=CSC=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=CSC=C2)CC3=CC=CC=C3Cl

InChI

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