2-(2,2-diphenyl-2-prop-2-ynoxy-ethanoyl)oxyethyl-dimethyl-azanium chloride

Systemtic Name: 2-(2,2-diphenyl-2-prop-2-ynoxy-ethanoyl)oxyethyl-dimethyl-azanium chloride Openeye Name: 2-(2,2-diphenyl-2-prop-2-ynoxy-acetyl)oxyethyl-dimethyl-ammonium chloride CAS Name: dimethyl-[2-(1-oxo-2,2-diphenyl-2-prop-2-ynoxyethoxy)ethyl]ammonium chloride IUPAC Name: 2-(2,2-diphenyl-2-prop-2-ynoxyacetyl)oxyethyl-dimethylazanium chloride Traditional Name: 2-(2,2-diphenyl-2-propargyloxy-acetyl)oxyethyl-dimethyl-ammonium chloride Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC#C.[Cl-]

Isomeric SMILES

C[NH+](C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC#C.[Cl-]

InChI

InChI=1S/C21H23NO3.ClH/c1-4-16-25-21(18-11-7-5-8-12-18,19-13-9-6-10-14-19)20(23)24-17-15-22(2)3;/h1,5-14H,15-17H2,2-3H3;1H