4-[4-(4-ethanoylphenyl)piperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[4-(4-ethanoylphenyl)piperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[4-(4-acetylphenyl)piperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[4-(4-acetylphenyl)-1-piperazinyl]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-(4-acetylphenyl)piperazin-1-yl]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[4-(4-acetylphenyl)piperazino]-N-methyl-3-nitro-benzenesulfonamide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S/c1-14(24)15-3-5-16(6-4-15)21-9-11-22(12-10-21)18-8-7-17(29(27,28)20-2)13-19(18)23(25)26/h3-8,13,20H,9-12H2,1-2H3