2-hydroxyethyl-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-(phenylmethyl)azanium

Systemtic Name: 2-hydroxyethyl-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-(2-hydroxyethyl)-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: 2-hydroxyethyl-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-(2-hydroxyethyl)-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: benzyl-(2-hydroxyethyl)-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C20H24N3O+ MolecularWeight: 322.42406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NN2)C[NH+](CCO)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NN2)C[NH+](CCO)CC3=CC=CC=C3

InChI

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