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

Systemtic Name: 1-(4-methylcyclohexyl)-4-[(2-nitrophenyl)methyl]piperazin-1-ium Openeye Name: 1-(4-methylcyclohexyl)-4-[(2-nitrophenyl)methyl]piperazin-1-ium CAS Name: 1-(4-methylcyclohexyl)-4-[(2-nitrophenyl)methyl]piperazin-1-ium IUPAC Name: 1-(4-methylcyclohexyl)-4-[(2-nitrophenyl)methyl]piperazin-1-ium Traditional Name: 1-(4-methylcyclohexyl)-4-(2-nitrobenzyl)piperazin-1-ium Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)[NH+]2CCN(CC2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)[NH+]2CCN(CC2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O2/c1-15-6-8-17(9-7-15)20-12-10-19(11-13-20)14-16-4-2-3-5-18(16)21(22)23/h2-5,15,17H,6-14H2,1H3/p+1