methyl (8E,10E,12E,14R)-14-oxidanylheptadeca-8,10,12-trien-4,6-diynoate

Systemtic Name: methyl (8E,10E,12E,14R)-14-oxidanylheptadeca-8,10,12-trien-4,6-diynoate Openeye Name: methyl (8E,10E,12E,14R)-14-hydroxyheptadeca-8,10,12-trien-4,6-diynoate CAS Name: (8E,10E,12E,14R)-14-hydroxyheptadeca-8,10,12-trien-4,6-diynoic acid methyl ester IUPAC Name: methyl (8E,10E,12E,14R)-14-hydroxyheptadeca-8,10,12-trien-4,6-diynoate Traditional Name: (8E,10E,12E,14R)-14-hydroxyheptadeca-8,10,12-trien-4,6-diynoic acid methyl ester Formula: C18H22O3 MolecularWeight: 286.36548

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C=CC=CC=CC#CC#CCCC(=O)OC)O

Isomeric SMILES

CCC[C@H](/C=C/C=C/C=C/C#CC#CCCC(=O)OC)O

InChI

InChI=1S/C18H22O3/c1-3-14-17(19)15-12-10-8-6-4-5-7-9-11-13-16-18(20)21-2/h4,6,8,10,12,15,17,19H,3,13-14,16H2,1-2H3/b6-4+,10-8+,15-12+/t17-/m1/s1