1-(2-nitrophenyl)sulfonyl-4-(4-phenylcyclohexyl)piperazin-4-ium

Systemtic Name: 1-(2-nitrophenyl)sulfonyl-4-(4-phenylcyclohexyl)piperazin-4-ium Openeye Name: 1-(2-nitrophenyl)sulfonyl-4-(4-phenylcyclohexyl)piperazin-4-ium CAS Name: 1-(2-nitrophenyl)sulfonyl-4-(4-phenylcyclohexyl)piperazin-4-ium IUPAC Name: 1-(2-nitrophenyl)sulfonyl-4-(4-phenylcyclohexyl)piperazin-4-ium Traditional Name: 1-(2-nitrophenyl)sulfonyl-4-(4-phenylcyclohexyl)piperazin-4-ium Formula: C22H28N3O4S+ MolecularWeight: 430.54042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=CC=C2)[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1C2=CC=CC=C2)[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O4S/c26-25(27)21-8-4-5-9-22(21)30(28,29)24-16-14-23(15-17-24)20-12-10-19(11-13-20)18-6-2-1-3-7-18/h1-9,19-20H,10-17H2/p+1