(8E,10E,14E)-6,7-bis(oxidanyl)henicosa-8,10,14-trien-12-yn-2-one

Systemtic Name: (8E,10E,14E)-6,7-bis(oxidanyl)henicosa-8,10,14-trien-12-yn-2-one Openeye Name: (8E,10E,14E)-6,7-dihydroxyhenicosa-8,10,14-trien-12-yn-2-one CAS Name: (8E,10E,14E)-6,7-dihydroxy-2-heneicosa-8,10,14-trien-12-ynone IUPAC Name: (8E,10E,14E)-6,7-dihydroxyhenicosa-8,10,14-trien-12-yn-2-one Traditional Name: (8E,10E,14E)-6,7-dihydroxyheneicosa-8,10,14-trien-12-yn-2-one Formula: C21H32O3 MolecularWeight: 332.47698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCC/C=C/C#C/C=C/C=C/C(C(CCCC(=O)C)O)O

InChI

InChI=1S/C21H32O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20(23)21(24)18-15-16-19(2)22/h8-9,12-14,17,20-21,23-24H,3-7,15-16,18H2,1-2H3/b9-8+,13-12+,17-14+