methyl (Z,13S)-13-oxidanyloctadec-9-en-11-ynoate

Systemtic Name: methyl (Z,13S)-13-oxidanyloctadec-9-en-11-ynoate Openeye Name: methyl (Z,13S)-13-hydroxyoctadec-9-en-11-ynoate CAS Name: (Z,13S)-13-hydroxyoctadec-9-en-11-ynoic acid methyl ester IUPAC Name: methyl (Z,13S)-13-hydroxyoctadec-9-en-11-ynoate Traditional Name: (Z,13S)-13-hydroxyoctadec-9-en-11-ynoic acid methyl ester Formula: C19H32O3 MolecularWeight: 308.45558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC[C@@H](C#C/C=C\CCCCCCCC(=O)OC)O

InChI

InChI=1S/C19H32O3/c1-3-4-12-15-18(20)16-13-10-8-6-5-7-9-11-14-17-19(21)22-2/h8,10,18,20H,3-7,9,11-12,14-15,17H2,1-2H3/b10-8-/t18-/m0/s1