(E)-octadec-9-enoate; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: (E)-octadec-9-enoate; 2-(trimethylazaniumyl)ethanoate Openeye Name: (E)-octadec-9-enoate; 2-(trimethylammonio)acetate CAS Name: (E)-9-octadecenoate; 2-(trimethylammonio)acetate IUPAC Name: (E)-octadec-9-enoate; 2-(trimethylazaniumyl)acetate Traditional Name: (E)-octadec-9-enoate; 2-(trimethylammonio)acetate Formula: C23H44NO4- MolecularWeight: 398.59976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H34O2.C5H11NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-6(2,3)4-5(7)8/h9-10H,2-8,11-17H2,1H3,(H,19,20);4H2,1-3H3/p-1/b10-9+;