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

Systemtic Name: [3-(3-fluorophenyl)-1-(3-methylphenyl)pyrazol-4-yl]methyl-bis(2-hydroxyethyl)azanium Openeye Name: [3-(3-fluorophenyl)-1-(m-tolyl)pyrazol-4-yl]methyl-bis(2-hydroxyethyl)ammonium CAS Name: [3-(3-fluorophenyl)-1-(3-methylphenyl)-4-pyrazolyl]methyl-bis(2-hydroxyethyl)ammonium IUPAC Name: [3-(3-fluorophenyl)-1-(3-methylphenyl)pyrazol-4-yl]methyl-bis(2-hydroxyethyl)azanium Traditional Name: [3-(3-fluorophenyl)-1-(m-tolyl)pyrazol-4-yl]methyl-bis(2-hydroxyethyl)ammonium Formula: C21H25FN3O2+ MolecularWeight: 370.440503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24FN3O2/c1-16-4-2-7-20(12-16)25-15-18(14-24(8-10-26)9-11-27)21(23-25)17-5-3-6-19(22)13-17/h2-7,12-13,15,26-27H,8-11,14H2,1H3/p+1