N-(6-chloranylquinolin-8-yl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(6-chloranylquinolin-8-yl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(6-chloro-8-quinolyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(6-chloro-8-quinolinyl)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(6-chloroquinolin-8-yl)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(6-chloro-8-quinolyl)-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4

InChI

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