N-tert-butyl-4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzenesulfonamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-tert-butyl-3-nitro-benzenesulfonamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-tert-butyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-tert-butyl-3-nitrobenzenesulfonamide Traditional Name: 4-(4-acetylpiperazino)-N-tert-butyl-3-nitro-benzenesulfonamide Formula: C16H24N4O5S MolecularWeight: 384.45056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N4O5S/c1-12(21)18-7-9-19(10-8-18)14-6-5-13(11-15(14)20(22)23)26(24,25)17-16(2,3)4/h5-6,11,17H,7-10H2,1-4H3