[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(2-hydroxyethyl)-methyl-azanium

Systemtic Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(2-hydroxyethyl)-methyl-azanium Openeye Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(2-hydroxyethyl)-methyl-ammonium CAS Name: [1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methyl-(2-hydroxyethyl)-methylammonium IUPAC Name: [1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methyl-(2-hydroxyethyl)-methylazanium Traditional Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-(2-hydroxyethyl)-methyl-ammonium Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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