(E)-octadec-9-enoic acid; 1-oxidanylpropan-2-olate

Systemtic Name: (E)-octadec-9-enoic acid; 1-oxidanylpropan-2-olate Openeye Name: 1-hydroxypropan-2-olate; (E)-octadec-9-enoic acid CAS Name: 1-hydroxy-2-propanolate; (E)-9-octadecenoic acid IUPAC Name: 1-hydroxypropan-2-olate; (E)-octadec-9-enoic acid Traditional Name: elaidic acid; 1-hydroxypropan-2-olate Formula: C21H41O4- MolecularWeight: 357.54784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)O.CC(CO)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H34O2.C3H7O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3(5)2-4/h9-10H,2-8,11-17H2,1H3,(H,19,20);3-4H,2H2,1H3/q;-1/b10-9+;