decanoate; (E)-octadec-9-enoate

Systemtic Name: decanoate; (E)-octadec-9-enoate Openeye Name: decanoate; (E)-octadec-9-enoate CAS Name: decanoate; (E)-9-octadecenoate IUPAC Name: decanoate; (E)-octadec-9-enoate Traditional Name: caprate; (E)-octadec-9-enoate Formula: C28H52O4-2 MolecularWeight: 452.71008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-]

Isomeric SMILES

CCCCCCCCCC(=O)[O-].CCCCCCCC/C=C/CCCCCCCC(=O)[O-]

InChI

InChI=1S/C18H34O2.C10H20O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-3-4-5-6-7-8-9-10(11)12/h9-10H,2-8,11-17H2,1H3,(H,19,20);2-9H2,1H3,(H,11,12)/p-2/b10-9+;