3-fluoranyl-N-[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]benzenesulfonamide

Systemtic Name: 3-fluoranyl-N-[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]benzenesulfonamide Openeye Name: 3-fluoro-N-[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]benzenesulfonamide CAS Name: 3-fluoro-N-[5-(4-methyl-1-piperazinyl)-2-nitrophenyl]benzenesulfonamide IUPAC Name: 3-fluoro-N-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]benzenesulfonamide Traditional Name: 3-fluoro-N-[5-(4-methylpiperazino)-2-nitro-phenyl]benzenesulfonamide Formula: C17H19FN4O4S MolecularWeight: 394.420563

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C17H19FN4O4S/c1-20-7-9-21(10-8-20)14-5-6-17(22(23)24)16(12-14)19-27(25,26)15-4-2-3-13(18)11-15/h2-6,11-12,19H,7-10H2,1H3