1-(4-chlorophenyl)-4-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]piperazin-4-ium

Systemtic Name: 1-(4-chlorophenyl)-4-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]piperazin-4-ium Openeye Name: 1-(4-chlorophenyl)-4-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]piperazin-4-ium CAS Name: 1-(4-chlorophenyl)-4-[2-(2,6,6-trimethyl-1-cyclohexenyl)ethyl]piperazin-4-ium IUPAC Name: 1-(4-chlorophenyl)-4-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]piperazin-4-ium Traditional Name: 1-(4-chlorophenyl)-4-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]piperazin-4-ium Formula: C21H32ClN2+ MolecularWeight: 347.94518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)CC[NH+]2CCN(CC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(CCC1)(C)C)CC[NH+]2CCN(CC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H31ClN2/c1-17-5-4-11-21(2,3)20(17)10-12-23-13-15-24(16-14-23)19-8-6-18(22)7-9-19/h6-9H,4-5,10-16H2,1-3H3/p+1