1-[2-(5-chloranylthiophen-2-yl)quinolin-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: 1-[2-(5-chloranylthiophen-2-yl)quinolin-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: 1-[2-(5-chloro-2-thienyl)quinoline-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[2-(5-chloro-2-thiophenyl)-4-quinolinyl]-oxomethyl]-4-piperidinecarboxylate IUPAC Name: 1-[2-(5-chlorothiophen-2-yl)quinoline-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[2-(5-chloro-2-thienyl)quinoline-4-carbonyl]isonipecotate Formula: C20H16ClN2O3S- MolecularWeight: 399.87064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl

InChI

InChI=1S/C20H17ClN2O3S/c21-18-6-5-17(27-18)16-11-14(13-3-1-2-4-15(13)22-16)19(24)23-9-7-12(8-10-23)20(25)26/h1-6,11-12H,7-10H2,(H,25,26)/p-1