ethyl 1-[2-[[3-(4-chlorophenyl)carbonylthiophen-2-yl]amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[[3-(4-chlorophenyl)carbonylthiophen-2-yl]amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[[3-(4-chlorobenzoyl)-2-thienyl]amino]-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: 1-[2-[[3-[(4-chlorophenyl)-oxomethyl]-2-thiophenyl]amino]-2-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[[3-(4-chlorobenzoyl)thiophen-2-yl]amino]-2-oxoethyl]piperidine-3-carboxylate Traditional Name: 1-[2-[[3-(4-chlorobenzoyl)-2-thienyl]amino]-2-keto-ethyl]nipecotic acid ethyl ester Formula: C21H23ClN2O4S MolecularWeight: 434.93632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC2=C(C=CS2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC(=O)NC2=C(C=CS2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O4S/c1-2-28-21(27)15-4-3-10-24(12-15)13-18(25)23-20-17(9-11-29-20)19(26)14-5-7-16(22)8-6-14/h5-9,11,15H,2-4,10,12-13H2,1H3,(H,23,25)