[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [3-(4-methylphenyl)-1-phenylpyrazol-4-yl]methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C24H25N4+ MolecularWeight: 369.4821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCC3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCC3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C24H24N4/c1-19-10-12-20(13-11-19)24-21(17-25-16-14-22-7-5-6-15-26-22)18-28(27-24)23-8-3-2-4-9-23/h2-13,15,18,25H,14,16-17H2,1H3/p+1