1-(3,5-dimethyl-1H-pyrazol-2-ium-2-yl)-3-(4-methoxyphenoxy)propan-2-ol chloride

Systemtic Name: 1-(3,5-dimethyl-1H-pyrazol-2-ium-2-yl)-3-(4-methoxyphenoxy)propan-2-ol chloride Openeye Name: 1-(3,5-dimethyl-1H-pyrazol-2-ium-2-yl)-3-(4-methoxyphenoxy)propan-2-ol chloride CAS Name: 1-(3,5-dimethyl-1H-pyrazol-2-ium-2-yl)-3-(4-methoxyphenoxy)-2-propanol chloride IUPAC Name: 1-(3,5-dimethyl-1H-pyrazol-2-ium-2-yl)-3-(4-methoxyphenoxy)propan-2-ol chloride Traditional Name: 1-(3,5-dimethyl-1H-pyrazol-2-ium-2-yl)-3-(4-methoxyphenoxy)propan-2-ol chloride Formula: C15H21ClN2O3 MolecularWeight: 312.79184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](N1)CC(COC2=CC=C(C=C2)OC)O)C.[Cl-]

Isomeric SMILES

CC1=CC(=[N+](N1)CC(COC2=CC=C(C=C2)OC)O)C.[Cl-]

InChI

InChI=1S/C15H20N2O3.ClH/c1-11-8-12(2)17(16-11)9-13(18)10-20-15-6-4-14(19-3)5-7-15;/h4-8,13,18H,9-10H2,1-3H3;1H