4-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-[4-(2-hydroxyphenyl)-1-piperazinyl]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-[4-(2-hydroxyphenyl)piperazino]-3-nitro-N-phenyl-benzenesulfonamide Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-])C4=CC=CC=C4O

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-])C4=CC=CC=C4O

InChI

InChI=1S/C22H22N4O5S/c27-22-9-5-4-8-20(22)25-14-12-24(13-15-25)19-11-10-18(16-21(19)26(28)29)32(30,31)23-17-6-2-1-3-7-17/h1-11,16,23,27H,12-15H2