2-[dimethyl-(5-methyl-4-oxidanylidene-hex-5-en-3-yl)azaniumyl]-2-methyl-propanoate

Systemtic Name: 2-[dimethyl-(5-methyl-4-oxidanylidene-hex-5-en-3-yl)azaniumyl]-2-methyl-propanoate Openeye Name: 2-[(1-ethyl-3-methyl-2-oxo-but-3-enyl)-dimethyl-ammonio]-2-methyl-propanoate CAS Name: 2-[dimethyl-(5-methyl-4-oxohex-5-en-3-yl)ammonio]-2-methylpropanoate IUPAC Name: 2-[dimethyl-(5-methyl-4-oxohex-5-en-3-yl)azaniumyl]-2-methylpropanoate Traditional Name: 2-[(1-ethyl-2-keto-3-methyl-but-3-enyl)-dimethyl-ammonio]-2-methyl-propionate Formula: C13H23NO3 MolecularWeight: 241.32662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C(=C)C)[N+](C)(C)C(C)(C)C(=O)[O-]

Isomeric SMILES

CCC(C(=O)C(=C)C)[N+](C)(C)C(C)(C)C(=O)[O-]

InChI

InChI=1S/C13H23NO3/c1-8-10(11(15)9(2)3)14(6,7)13(4,5)12(16)17/h10H,2,8H2,1,3-7H3