ethyl 1-(2-thiophen-3-ylquinolin-4-yl)carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-(2-thiophen-3-ylquinolin-4-yl)carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[2-(3-thienyl)quinoline-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[oxo-[2-(3-thiophenyl)-4-quinolinyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-thiophen-3-ylquinoline-4-carbonyl)piperidine-3-carboxylate Traditional Name: 1-[2-(3-thienyl)quinoline-4-carbonyl]nipecotic acid ethyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CSC=C4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CSC=C4

InChI

InChI=1S/C22H22N2O3S/c1-2-27-22(26)15-6-5-10-24(13-15)21(25)18-12-20(16-9-11-28-14-16)23-19-8-4-3-7-17(18)19/h3-4,7-9,11-12,14-15H,2,5-6,10,13H2,1H3