2-(4-ethanoylpiperazin-1-yl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-(4-ethanoylpiperazin-1-yl)-5-nitro-benzenesulfonamide Openeye Name: 2-(4-acetylpiperazin-1-yl)-5-nitro-benzenesulfonamide CAS Name: 2-(4-acetyl-1-piperazinyl)-5-nitrobenzenesulfonamide IUPAC Name: 2-(4-acetylpiperazin-1-yl)-5-nitrobenzenesulfonamide Traditional Name: 2-(4-acetylpiperazino)-5-nitro-benzenesulfonamide Formula: C12H16N4O5S MolecularWeight: 328.34424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C12H16N4O5S/c1-9(17)14-4-6-15(7-5-14)11-3-2-10(16(18)19)8-12(11)22(13,20)21/h2-3,8H,4-7H2,1H3,(H2,13,20,21)