N-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]-N,1-dimethyl-piperidin-1-ium-4-amine

Systemtic Name: N-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]-N,1-dimethyl-piperidin-1-ium-4-amine Openeye Name: N-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]-N,1-dimethyl-piperidin-1-ium-4-amine CAS Name: N-[[3-(4-cyclohexylphenyl)-1-methyl-4-pyrazolyl]methyl]-N,1-dimethyl-4-piperidin-1-iumamine IUPAC Name: N-[[3-(4-cyclohexylphenyl)-1-methylpyrazol-4-yl]methyl]-N,1-dimethylpiperidin-1-ium-4-amine Traditional Name: [3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)amine Formula: C24H37N4+ MolecularWeight: 381.57738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)CC2=CN(N=C2C3=CC=C(C=C3)C4CCCCC4)C

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)CC2=CN(N=C2C3=CC=C(C=C3)C4CCCCC4)C

InChI

InChI=1S/C24H36N4/c1-26-15-13-23(14-16-26)27(2)17-22-18-28(3)25-24(22)21-11-9-20(10-12-21)19-7-5-4-6-8-19/h9-12,18-19,23H,4-8,13-17H2,1-3H3/p+1