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

Systemtic Name: 1-(4-nitrophenyl)-4-(4-phenylcyclohexyl)piperazin-4-ium Openeye Name: 1-(4-nitrophenyl)-4-(4-phenylcyclohexyl)piperazin-4-ium CAS Name: 1-(4-nitrophenyl)-4-(4-phenylcyclohexyl)piperazin-4-ium IUPAC Name: 1-(4-nitrophenyl)-4-(4-phenylcyclohexyl)piperazin-4-ium Traditional Name: 1-(4-nitrophenyl)-4-(4-phenylcyclohexyl)piperazin-4-ium Formula: C22H28N3O2+ MolecularWeight: 366.47662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2/c26-25(27)22-12-10-21(11-13-22)24-16-14-23(15-17-24)20-8-6-19(7-9-20)18-4-2-1-3-5-18/h1-5,10-13,19-20H,6-9,14-17H2/p+1