hexa-1,5-dien-3-yl-dimethyl-(2-oxidanylidene-2-prop-2-ynoxy-ethyl)azanium chloride

Systemtic Name: hexa-1,5-dien-3-yl-dimethyl-(2-oxidanylidene-2-prop-2-ynoxy-ethyl)azanium chloride Openeye Name: dimethyl-(2-oxo-2-prop-2-ynoxy-ethyl)-(1-vinylbut-3-enyl)ammonium chloride CAS Name: hexa-1,5-dien-3-yl-dimethyl-(2-oxo-2-prop-2-ynoxyethyl)ammonium chloride IUPAC Name: hexa-1,5-dien-3-yl-dimethyl-(2-oxo-2-prop-2-ynoxyethyl)azanium chloride Traditional Name: (2-keto-2-propargyloxy-ethyl)-dimethyl-(1-vinylbut-3-enyl)ammonium chloride Formula: C13H20ClNO2 MolecularWeight: 257.7564

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC(=O)OCC#C)C(CC=C)C=C.[Cl-]

Isomeric SMILES

C[N+](C)(CC(=O)OCC#C)C(CC=C)C=C.[Cl-]

InChI

InChI=1S/C13H20NO2.ClH/c1-6-9-12(8-3)14(4,5)11-13(15)16-10-7-2;/h2,6,8,12H,1,3,9-11H2,4-5H3;1H/q+1;/p-1