(E)-4-methyl-3-oxidanylidene-2-[1-oxidanyl-2-(trimethylazaniumyl)ethyl]hex-4-enoate

Systemtic Name: (E)-4-methyl-3-oxidanylidene-2-[1-oxidanyl-2-(trimethylazaniumyl)ethyl]hex-4-enoate Openeye Name: (E)-2-[1-hydroxy-2-(trimethylammonio)ethyl]-4-methyl-3-oxo-hex-4-enoate CAS Name: (E)-2-[1-hydroxy-2-(trimethylammonio)ethyl]-4-methyl-3-oxo-4-hexenoate IUPAC Name: (E)-2-[1-hydroxy-2-(trimethylazaniumyl)ethyl]-4-methyl-3-oxohex-4-enoate Traditional Name: (E)-2-[1-hydroxy-2-(trimethylammonio)ethyl]-3-keto-4-methyl-hex-4-enoate Formula: C12H21NO4 MolecularWeight: 243.29944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C(\C)/C(=O)C(C(C[N+](C)(C)C)O)C(=O)[O-]

InChI

InChI=1S/C12H21NO4/c1-6-8(2)11(15)10(12(16)17)9(14)7-13(3,4)5/h6,9-10,14H,7H2,1-5H3/b8-6+