methyl 11-oxidanyloctadeca-9,12-diynoate

Systemtic Name: methyl 11-oxidanyloctadeca-9,12-diynoate Openeye Name: methyl 11-hydroxyoctadeca-9,12-diynoate CAS Name: 11-hydroxyoctadeca-9,12-diynoic acid methyl ester IUPAC Name: methyl 11-hydroxyoctadeca-9,12-diynoate Traditional Name: 11-hydroxyoctadeca-9,12-diynoic acid methyl ester Formula: C19H30O3 MolecularWeight: 306.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC(C#CCCCCCCCC(=O)OC)O

Isomeric SMILES

CCCCCC#CC(C#CCCCCCCCC(=O)OC)O

InChI

InChI=1S/C19H30O3/c1-3-4-5-9-12-15-18(20)16-13-10-7-6-8-11-14-17-19(21)22-2/h18,20H,3-11,14,17H2,1-2H3