1-[(2-nitrophenyl)methyl]-4-(4-phenylcyclohexyl)piperazin-4-ium

Systemtic Name: 1-[(2-nitrophenyl)methyl]-4-(4-phenylcyclohexyl)piperazin-4-ium Openeye Name: 1-[(2-nitrophenyl)methyl]-4-(4-phenylcyclohexyl)piperazin-4-ium CAS Name: 1-[(2-nitrophenyl)methyl]-4-(4-phenylcyclohexyl)piperazin-4-ium IUPAC Name: 1-[(2-nitrophenyl)methyl]-4-(4-phenylcyclohexyl)piperazin-4-ium Traditional Name: 1-(2-nitrobenzyl)-4-(4-phenylcyclohexyl)piperazin-4-ium Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=CC=C2)[NH+]3CCN(CC3)CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1C2=CC=CC=C2)[NH+]3CCN(CC3)CC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O2/c27-26(28)23-9-5-4-8-21(23)18-24-14-16-25(17-15-24)22-12-10-20(11-13-22)19-6-2-1-3-7-19/h1-9,20,22H,10-18H2/p+1