ethyl 1-(4-chloranyl-8-methyl-thieno[3,2-c]quinolin-2-yl)carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-(4-chloranyl-8-methyl-thieno[3,2-c]quinolin-2-yl)carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-(4-chloro-8-methyl-thieno[3,2-c]quinoline-2-carbonyl)piperidine-3-carboxylate CAS Name: 1-[(4-chloro-8-methyl-2-thieno[3,2-c]quinolinyl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-chloro-8-methylthieno[3,2-c]quinoline-2-carbonyl)piperidine-3-carboxylate Traditional Name: 1-(4-chloro-8-methyl-thieno[3,2-c]quinoline-2-carbonyl)nipecotic acid ethyl ester Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(S2)C4=C(C=CC(=C4)C)N=C3Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(S2)C4=C(C=CC(=C4)C)N=C3Cl

InChI

InChI=1S/C21H21ClN2O3S/c1-3-27-21(26)13-5-4-8-24(11-13)20(25)17-10-15-18(28-17)14-9-12(2)6-7-16(14)23-19(15)22/h6-7,9-10,13H,3-5,8,11H2,1-2H3