ethyl 1-(5-methyl-4-oxidanylidene-thieno[3,2-c]quinolin-2-yl)carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-(5-methyl-4-oxidanylidene-thieno[3,2-c]quinolin-2-yl)carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-(5-methyl-4-oxo-thieno[3,2-c]quinoline-2-carbonyl)piperidine-3-carboxylate CAS Name: 1-[(5-methyl-4-oxo-2-thieno[3,2-c]quinolinyl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(5-methyl-4-oxothieno[3,2-c]quinoline-2-carbonyl)piperidine-3-carboxylate Traditional Name: 1-(4-keto-5-methyl-thieno[3,2-c]quinoline-2-carbonyl)nipecotic acid ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(S2)C4=CC=CC=C4N(C3=O)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(S2)C4=CC=CC=C4N(C3=O)C

InChI

InChI=1S/C21H22N2O4S/c1-3-27-21(26)13-7-6-10-23(12-13)20(25)17-11-15-18(28-17)14-8-4-5-9-16(14)22(2)19(15)24/h4-5,8-9,11,13H,3,6-7,10,12H2,1-2H3