N-[2,6-bis(fluoranyl)phenyl]-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2,6-bis(fluoranyl)phenyl]-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,6-difluorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(2,6-difluorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2,6-difluorophenyl)-1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,6-difluorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-isonipecotamide Formula: C20H22F2N2O5S MolecularWeight: 440.460886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC=C3F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC=C3F)F)OC

InChI

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