2-[2-[(1E,3E)-5-oxidanyltrideca-1,3-dienyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(1E,3E)-5-oxidanyltrideca-1,3-dienyl]phenoxy]ethanoic acid Openeye Name: 2-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenoxy]acetic acid CAS Name: 2-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenoxy]acetic acid IUPAC Name: 2-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenoxy]acetic acid Traditional Name: 2-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenoxy]acetic acid Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC=CC1=CC=CC=C1OCC(=O)O)O

Isomeric SMILES

CCCCCCCCC(/C=C/C=C/C1=CC=CC=C1OCC(=O)O)O

InChI

InChI=1S/C21H30O4/c1-2-3-4-5-6-7-14-19(22)15-10-8-12-18-13-9-11-16-20(18)25-17-21(23)24/h8-13,15-16,19,22H,2-7,14,17H2,1H3,(H,23,24)/b12-8+,15-10+