1-[2,5-bis(fluoranyl)phenyl]sulfonyl-N-(3-chloranyl-4-methoxy-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2,5-bis(fluoranyl)phenyl]sulfonyl-N-(3-chloranyl-4-methoxy-phenyl)piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-1-(2,5-difluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-1-(2,5-difluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-1-(2,5-difluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-1-(2,5-difluorophenyl)sulfonyl-isonipecotamide Formula: C19H19ClF2N2O4S MolecularWeight: 444.879966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F)Cl

InChI

InChI=1S/C19H19ClF2N2O4S/c1-28-17-5-3-14(11-15(17)20)23-19(25)12-6-8-24(9-7-12)29(26,27)18-10-13(21)2-4-16(18)22/h2-5,10-12H,6-9H2,1H3,(H,23,25)