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

Systemtic Name: 1-[2,5-bis(fluoranyl)phenyl]sulfonyl-N-(3,4-dimethoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-(2,5-difluorophenyl)sulfonyl-N-(3,4-dimethoxyphenyl)piperidine-4-carboxamide CAS Name: 1-(2,5-difluorophenyl)sulfonyl-N-(3,4-dimethoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2,5-difluorophenyl)sulfonyl-N-(3,4-dimethoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(2,5-difluorophenyl)sulfonyl-N-(3,4-dimethoxyphenyl)isonipecotamide Formula: C20H22F2N2O5S MolecularWeight: 440.460886

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H22F2N2O5S/c1-28-17-6-4-15(12-18(17)29-2)23-20(25)13-7-9-24(10-8-13)30(26,27)19-11-14(21)3-5-16(19)22/h3-6,11-13H,7-10H2,1-2H3,(H,23,25)