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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[3,5-bis(fluoranyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(3,5-difluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-(3,5-difluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(3,5-difluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(3,5-difluorophenyl)sulfonyl-isonipecotamide Formula: C19H18F2N2O5S MolecularWeight: 424.418426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC(=CC(=C4)F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC(=CC(=C4)F)F

InChI

InChI=1S/C19H18F2N2O5S/c20-13-7-14(21)9-16(8-13)29(25,26)23-5-3-12(4-6-23)19(24)22-15-1-2-17-18(10-15)28-11-27-17/h1-2,7-10,12H,3-6,11H2,(H,22,24)