4-fluoranyl-N-[1-(2,3,4-trimethoxyphenyl)carbonylpiperidin-4-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[1-(2,3,4-trimethoxyphenyl)carbonylpiperidin-4-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[1-(2,3,4-trimethoxybenzoyl)-4-piperidyl]benzenesulfonamide CAS Name: 4-fluoro-N-[1-[oxo-(2,3,4-trimethoxyphenyl)methyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[1-(2,3,4-trimethoxybenzoyl)piperidin-4-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[1-(2,3,4-trimethoxybenzoyl)-4-piperidyl]benzenesulfonamide Formula: C21H25FN2O6S MolecularWeight: 452.496403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=C(C=C3)F)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=C(C=C3)F)OC)OC

InChI

InChI=1S/C21H25FN2O6S/c1-28-18-9-8-17(19(29-2)20(18)30-3)21(25)24-12-10-15(11-13-24)23-31(26,27)16-6-4-14(22)5-7-16/h4-9,15,23H,10-13H2,1-3H3