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

Systemtic Name: (2-methylphenyl)methyl-[[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methyl]azanium Openeye Name: [1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyl-(o-tolylmethyl)ammonium CAS Name: (2-methylphenyl)methyl-[[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]methyl]ammonium IUPAC Name: (1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methyl-[(2-methylphenyl)methyl]azanium Traditional Name: [1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyl-(2-methylbenzyl)ammonium Formula: C24H25N4+ MolecularWeight: 369.4821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH2+]CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C[NH2+]CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

InChI

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