1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-(2-methoxy-5-methyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-(2-methoxy-5-methyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-(2-methoxy-5-methyl-phenyl)piperidine-4-carboxamide CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-(2-methoxy-5-methylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-(2-methoxy-5-methylphenyl)piperidine-4-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-(2-methoxy-5-methyl-phenyl)isonipecotamide Formula: C20H22ClFN2O4S MolecularWeight: 440.916083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H22ClFN2O4S/c1-13-3-6-19(28-2)18(11-13)23-20(25)14-7-9-24(10-8-14)29(26,27)15-4-5-17(22)16(21)12-15/h3-6,11-12,14H,7-10H2,1-2H3,(H,23,25)