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

Systemtic Name: N,1-dimethyl-N-[[3-(3-methylphenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-amine Openeye Name: N,1-dimethyl-N-[[3-(m-tolyl)-1-(p-tolyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-amine CAS Name: N,1-dimethyl-N-[[3-(3-methylphenyl)-1-(4-methylphenyl)-4-pyrazolyl]methyl]-4-piperidin-1-iumamine IUPAC Name: N,1-dimethyl-N-[[3-(3-methylphenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-amine Traditional Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[[3-(m-tolyl)-1-(p-tolyl)pyrazol-4-yl]methyl]amine Formula: C25H33N4+ MolecularWeight: 389.55632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)C)CN(C)C4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)C)CN(C)C4CC[NH+](CC4)C

InChI

InChI=1S/C25H32N4/c1-19-8-10-24(11-9-19)29-18-22(17-28(4)23-12-14-27(3)15-13-23)25(26-29)21-7-5-6-20(2)16-21/h5-11,16,18,23H,12-15,17H2,1-4H3/p+1