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

Systemtic Name: [3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl-(2-hydroxyethyl)-(phenylmethyl)azanium Openeye Name: benzyl-[[3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl]-(2-hydroxyethyl)ammonium CAS Name: [3-(3-chlorophenyl)-1-methyl-4-pyrazolyl]methyl-(2-hydroxyethyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-[[3-(3-chlorophenyl)-1-methylpyrazol-4-yl]methyl]-(2-hydroxyethyl)azanium Traditional Name: benzyl-[[3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl]-(2-hydroxyethyl)ammonium Formula: C20H23ClN3O+ MolecularWeight: 356.86912

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC(=CC=C2)Cl)C[NH+](CCO)CC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C(=N1)C2=CC(=CC=C2)Cl)C[NH+](CCO)CC3=CC=CC=C3

InChI

InChI=1S/C20H22ClN3O/c1-23-14-18(20(22-23)17-8-5-9-19(21)12-17)15-24(10-11-25)13-16-6-3-2-4-7-16/h2-9,12,14,25H,10-11,13,15H2,1H3/p+1