1-(diphenylmethyl)-4-(3-nitrophenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(diphenylmethyl)-4-(3-nitrophenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-benzhydryl-4-(3-nitrophenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(diphenylmethyl)-4-(3-nitrophenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-benzhydryl-4-(3-nitrophenyl)sulfonylpiperazin-1-ium Traditional Name: 1-benzhydryl-4-(3-nitrophenyl)sulfonyl-piperazin-1-ium Formula: C23H24N3O4S+ MolecularWeight: 438.51936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O4S/c27-26(28)21-12-7-13-22(18-21)31(29,30)25-16-14-24(15-17-25)23(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-13,18,23H,14-17H2/p+1