N-[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]methanesulfonamide

Systemtic Name: N-[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]methanesulfonamide Openeye Name: N-[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]methanesulfonamide CAS Name: N-[5-(4-methyl-1-piperazinyl)-2-nitrophenyl]methanesulfonamide IUPAC Name: N-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]methanesulfonamide Traditional Name: N-[5-(4-methylpiperazino)-2-nitro-phenyl]methanesulfonamide Formula: C12H18N4O4S MolecularWeight: 314.36072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N4O4S/c1-14-5-7-15(8-6-14)10-3-4-12(16(17)18)11(9-10)13-21(2,19)20/h3-4,9,13H,5-8H2,1-2H3