2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-2-[3-(6-oxidanylhex-1-ynyl)phenoxy]octanoic acid

Systemtic Name: 2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-2-[3-(6-oxidanylhex-1-ynyl)phenoxy]octanoic acid Openeye Name: 2-[3-(6-hydroxyhex-1-ynyl)phenoxy]-2-[(E)-3-methoxy-3-oxo-prop-1-enyl]octanoic acid CAS Name: 2-[3-(6-hydroxyhex-1-ynyl)phenoxy]-2-[(E)-3-methoxy-3-oxoprop-1-enyl]octanoic acid IUPAC Name: 2-[3-(6-hydroxyhex-1-ynyl)phenoxy]-2-[(E)-3-methoxy-3-oxoprop-1-enyl]octanoic acid Traditional Name: (E)-2-hexyl-2-[3-(6-hydroxyhex-1-ynyl)phenoxy]-5-keto-5-methoxy-pent-3-enoic acid Formula: C24H32O6 MolecularWeight: 416.50728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C=CC(=O)OC)(C(=O)O)OC1=CC=CC(=C1)C#CCCCCO

Isomeric SMILES

CCCCCCC(/C=C/C(=O)OC)(C(=O)O)OC1=CC=CC(=C1)C#CCCCCO

InChI

InChI=1S/C24H32O6/c1-3-4-5-9-16-24(23(27)28,17-15-22(26)29-2)30-21-14-11-13-20(19-21)12-8-6-7-10-18-25/h11,13-15,17,19,25H,3-7,9-10,16,18H2,1-2H3,(H,27,28)/b17-15+