1-ethoxyethane-1,1-diol; (E)-octadec-9-enoic acid

Systemtic Name: 1-ethoxyethane-1,1-diol; (E)-octadec-9-enoic acid Openeye Name: 1-ethoxyethane-1,1-diol; (E)-octadec-9-enoic acid CAS Name: 1-ethoxyethane-1,1-diol; (E)-9-octadecenoic acid IUPAC Name: 1-ethoxyethane-1,1-diol; (E)-octadec-9-enoic acid Traditional Name: elaidic acid; 1-ethoxyethane-1,1-diol Formula: C22H44O5 MolecularWeight: 388.58176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)O.CCOC(C)(O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)O.CCOC(C)(O)O

InChI

InChI=1S/C18H34O2.C4H10O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3-7-4(2,5)6/h9-10H,2-8,11-17H2,1H3,(H,19,20);5-6H,3H2,1-2H3/b10-9+;