N-(3-chlorophenyl)-1-(8-methoxyquinolin-5-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chlorophenyl)-1-(8-methoxyquinolin-5-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chlorophenyl)-1-[(8-methoxy-5-quinolyl)sulfonyl]piperidine-4-carboxamide CAS Name: N-(3-chlorophenyl)-1-[(8-methoxy-5-quinolinyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chlorophenyl)-1-(8-methoxyquinolin-5-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chlorophenyl)-1-[(8-methoxy-5-quinolyl)sulfonyl]isonipecotamide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC(=CC=C4)Cl)C=CC=N2

Isomeric SMILES

COC1=C2C(=C(C=C1)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC(=CC=C4)Cl)C=CC=N2

InChI

InChI=1S/C22H22ClN3O4S/c1-30-19-7-8-20(18-6-3-11-24-21(18)19)31(28,29)26-12-9-15(10-13-26)22(27)25-17-5-2-4-16(23)14-17/h2-8,11,14-15H,9-10,12-13H2,1H3,(H,25,27)