4-fluoranyl-N-[1-(3-methyl-2-nitro-phenyl)carbonylpiperidin-4-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[1-(3-methyl-2-nitro-phenyl)carbonylpiperidin-4-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[1-(3-methyl-2-nitro-benzoyl)-4-piperidyl]benzenesulfonamide CAS Name: 4-fluoro-N-[1-[(3-methyl-2-nitrophenyl)-oxomethyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[1-(3-methyl-2-nitrobenzoyl)piperidin-4-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[1-(3-methyl-2-nitro-benzoyl)-4-piperidyl]benzenesulfonamide Formula: C19H20FN3O5S MolecularWeight: 421.442603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H20FN3O5S/c1-13-3-2-4-17(18(13)23(25)26)19(24)22-11-9-15(10-12-22)21-29(27,28)16-7-5-14(20)6-8-16/h2-8,15,21H,9-12H2,1H3