3-nitro-4-(4-phenylpiperazin-1-yl)benzenesulfonamide

Systemtic Name: 3-nitro-4-(4-phenylpiperazin-1-yl)benzenesulfonamide Openeye Name: 3-nitro-4-(4-phenylpiperazin-1-yl)benzenesulfonamide CAS Name: 3-nitro-4-(4-phenyl-1-piperazinyl)benzenesulfonamide IUPAC Name: 3-nitro-4-(4-phenylpiperazin-1-yl)benzenesulfonamide Traditional Name: 3-nitro-4-(4-phenylpiperazino)benzenesulfonamide Formula: C16H18N4O4S MolecularWeight: 362.40352

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O4S/c17-25(23,24)14-6-7-15(16(12-14)20(21)22)19-10-8-18(9-11-19)13-4-2-1-3-5-13/h1-7,12H,8-11H2,(H2,17,23,24)