1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(4-fluoranyl-3-methyl-phenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(4-fluoranyl-3-methyl-phenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(4-fluoro-3-methyl-phenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(4-fluoro-3-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(4-fluoro-3-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(4-fluoro-3-methyl-benzyl)isonipecotamide Formula: C22H25FN2O5S MolecularWeight: 448.507703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4)F

InChI

InChI=1S/C22H25FN2O5S/c1-15-12-16(2-4-19(15)23)14-24-22(26)17-6-8-25(9-7-17)31(27,28)18-3-5-20-21(13-18)30-11-10-29-20/h2-5,12-13,17H,6-11,14H2,1H3,(H,24,26)