(3,4-dimethoxyphenyl)-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (3,4-dimethoxyphenyl)-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]methanone Openeye Name: (3,4-dimethoxyphenyl)-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]methanone CAS Name: (3,4-dimethoxyphenyl)-[4-(4-phenylcyclohexyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]methanone Traditional Name: (3,4-dimethoxyphenyl)-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]methanone Formula: C25H33N2O3+ MolecularWeight: 409.54112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)C3CCC(CC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)C3CCC(CC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H32N2O3/c1-29-23-13-10-21(18-24(23)30-2)25(28)27-16-14-26(15-17-27)22-11-8-20(9-12-22)19-6-4-3-5-7-19/h3-7,10,13,18,20,22H,8-9,11-12,14-17H2,1-2H3/p+1