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

Systemtic Name: 1-methyl-N-[[3-(3-methylphenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-amine Openeye Name: 1-methyl-N-[[3-(m-tolyl)-1-(p-tolyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-amine CAS Name: 1-methyl-N-[[3-(3-methylphenyl)-1-(4-methylphenyl)-4-pyrazolyl]methyl]-4-piperidin-1-iumamine IUPAC Name: 1-methyl-N-[[3-(3-methylphenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-amine Traditional Name: (1-methylpiperidin-1-ium-4-yl)-[[3-(m-tolyl)-1-(p-tolyl)pyrazol-4-yl]methyl]amine Formula: C24H31N4+ MolecularWeight: 375.52974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)C)CNC4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)C)CNC4CC[NH+](CC4)C

InChI

InChI=1S/C24H30N4/c1-18-7-9-23(10-8-18)28-17-21(16-25-22-11-13-27(3)14-12-22)24(26-28)20-6-4-5-19(2)15-20/h4-10,15,17,22,25H,11-14,16H2,1-3H3/p+1