[(E)-3-(dimethylamino)-2-methyl-3-oxidanylidene-prop-1-enyl]-methyl-(3-methylbutyl)azanium chloride

Systemtic Name: [(E)-3-(dimethylamino)-2-methyl-3-oxidanylidene-prop-1-enyl]-methyl-(3-methylbutyl)azanium chloride Openeye Name: [(E)-3-(dimethylamino)-2-methyl-3-oxo-prop-1-enyl]-isopentyl-methyl-ammonium chloride CAS Name: [(E)-3-(dimethylamino)-2-methyl-3-oxoprop-1-enyl]-methyl-(3-methylbutyl)ammonium chloride IUPAC Name: [(E)-3-(dimethylamino)-2-methyl-3-oxoprop-1-enyl]-methyl-(3-methylbutyl)azanium chloride Traditional Name: [(E)-3-(dimethylamino)-3-keto-2-methyl-prop-1-enyl]-isoamyl-methyl-ammonium chloride Formula: C12H25ClN2O MolecularWeight: 248.7927

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)CC[NH+](C)/C=C(\C)/C(=O)N(C)C.[Cl-]

InChI

InChI=1S/C12H24N2O.ClH/c1-10(2)7-8-14(6)9-11(3)12(15)13(4)5;/h9-10H,7-8H2,1-6H3;1H/b11-9+;