(E)-3-oxidanylidene-2-[1-oxidanyl-2-(trimethylazaniumyl)ethyl]hexadec-11-enoate

Systemtic Name: (E)-3-oxidanylidene-2-[1-oxidanyl-2-(trimethylazaniumyl)ethyl]hexadec-11-enoate Openeye Name: (E)-2-[1-hydroxy-2-(trimethylammonio)ethyl]-3-oxo-hexadec-11-enoate CAS Name: (E)-2-[1-hydroxy-2-(trimethylammonio)ethyl]-3-oxo-11-hexadecenoate IUPAC Name: (E)-2-[1-hydroxy-2-(trimethylazaniumyl)ethyl]-3-oxohexadec-11-enoate Traditional Name: (E)-2-[1-hydroxy-2-(trimethylammonio)ethyl]-3-keto-hexadec-11-enoate Formula: C21H39NO4 MolecularWeight: 369.53866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CCCCCCCCC(=O)C(C(C[N+](C)(C)C)O)C(=O)[O-]

Isomeric SMILES

CCCC/C=C/CCCCCCCC(=O)C(C(C[N+](C)(C)C)O)C(=O)[O-]

InChI

InChI=1S/C21H39NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-18(23)20(21(25)26)19(24)17-22(2,3)4/h8-9,19-20,24H,5-7,10-17H2,1-4H3/b9-8+