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

Systemtic Name: 2,4-bis(fluoranyl)-N-[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]benzenesulfonamide Openeye Name: 2,4-difluoro-N-[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]benzenesulfonamide CAS Name: 2,4-difluoro-N-[5-(4-methyl-1-piperazinyl)-2-nitrophenyl]benzenesulfonamide IUPAC Name: 2,4-difluoro-N-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]benzenesulfonamide Traditional Name: 2,4-difluoro-N-[5-(4-methylpiperazino)-2-nitro-phenyl]benzenesulfonamide Formula: C17H18F2N4O4S MolecularWeight: 412.411026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18F2N4O4S/c1-21-6-8-22(9-7-21)13-3-4-16(23(24)25)15(11-13)20-28(26,27)17-5-2-12(18)10-14(17)19/h2-5,10-11,20H,6-9H2,1H3