methyl (E)-15-oxidanylicos-5-en-11,13-diynoate

Systemtic Name: methyl (E)-15-oxidanylicos-5-en-11,13-diynoate Openeye Name: methyl (E)-15-hydroxyicos-5-en-11,13-diynoate CAS Name: (E)-15-hydroxyeicos-5-en-11,13-diynoic acid methyl ester IUPAC Name: methyl (E)-15-hydroxyicos-5-en-11,13-diynoate Traditional Name: (E)-15-hydroxyeicos-5-en-11,13-diynoic acid methyl ester Formula: C21H32O3 MolecularWeight: 332.47698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCC(C#CC#CCCCC/C=C/CCCC(=O)OC)O

InChI

InChI=1S/C21H32O3/c1-3-4-14-17-20(22)18-15-12-10-8-6-5-7-9-11-13-16-19-21(23)24-2/h9,11,20,22H,3-8,13-14,16-17,19H2,1-2H3/b11-9+