1-[4-(4-nitrophenoxy)phenyl]sulfonyl-4-(phenylmethyl)piperazine

Systemtic Name: 1-[4-(4-nitrophenoxy)phenyl]sulfonyl-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[4-(4-nitrophenoxy)phenyl]sulfonyl-piperazine CAS Name: 1-[4-(4-nitrophenoxy)phenyl]sulfonyl-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-[4-(4-nitrophenoxy)phenyl]sulfonylpiperazine Traditional Name: 1-benzyl-4-[4-(4-nitrophenoxy)phenyl]sulfonyl-piperazine Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O5S/c27-26(28)20-6-8-21(9-7-20)31-22-10-12-23(13-11-22)32(29,30)25-16-14-24(15-17-25)18-19-4-2-1-3-5-19/h1-13H,14-18H2