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

Systemtic Name: 2-hydroxyethyl-methyl-[[3-(3-methylphenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]azanium Openeye Name: 2-hydroxyethyl-methyl-[[3-(m-tolyl)-1-(p-tolyl)pyrazol-4-yl]methyl]ammonium CAS Name: 2-hydroxyethyl-methyl-[[3-(3-methylphenyl)-1-(4-methylphenyl)-4-pyrazolyl]methyl]ammonium IUPAC Name: 2-hydroxyethyl-methyl-[[3-(3-methylphenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]azanium Traditional Name: 2-hydroxyethyl-methyl-[[3-(m-tolyl)-1-(p-tolyl)pyrazol-4-yl]methyl]ammonium Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O/c1-16-7-9-20(10-8-16)24-15-19(14-23(3)11-12-25)21(22-24)18-6-4-5-17(2)13-18/h4-10,13,15,25H,11-12,14H2,1-3H3/p+1