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

Systemtic Name: 2-hydroxyethyl-[[3-(4-methylphenyl)-1-(phenylmethyl)pyrazol-4-yl]methyl]azanium Openeye Name: [1-benzyl-3-(p-tolyl)pyrazol-4-yl]methyl-(2-hydroxyethyl)ammonium CAS Name: 2-hydroxyethyl-[[3-(4-methylphenyl)-1-(phenylmethyl)-4-pyrazolyl]methyl]ammonium IUPAC Name: [1-benzyl-3-(4-methylphenyl)pyrazol-4-yl]methyl-(2-hydroxyethyl)azanium Traditional Name: [1-benzyl-3-(p-tolyl)pyrazol-4-yl]methyl-(2-hydroxyethyl)ammonium Formula: C20H24N3O+ MolecularWeight: 322.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCO)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCO)CC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O/c1-16-7-9-18(10-8-16)20-19(13-21-11-12-24)15-23(22-20)14-17-5-3-2-4-6-17/h2-10,15,21,24H,11-14H2,1H3/p+1