4-[3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-4-(6-oxidanylhexyl)phenoxy]butanoic acid

Systemtic Name: 4-[3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-4-(6-oxidanylhexyl)phenoxy]butanoic acid Openeye Name: 4-[4-(6-hydroxyhexyl)-3-[(E)-3-methoxy-3-oxo-prop-1-enyl]phenoxy]butanoic acid CAS Name: 4-[4-(6-hydroxyhexyl)-3-[(E)-3-methoxy-3-oxoprop-1-enyl]phenoxy]butanoic acid IUPAC Name: 4-[4-(6-hydroxyhexyl)-3-[(E)-3-methoxy-3-oxoprop-1-enyl]phenoxy]butanoic acid Traditional Name: 4-[4-(6-hydroxyhexyl)-3-[(E)-3-keto-3-methoxy-prop-1-enyl]phenoxy]butyric acid Formula: C20H28O6 MolecularWeight: 364.43272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=C(C=CC(=C1)OCCCC(=O)O)CCCCCCO

Isomeric SMILES

COC(=O)/C=C/C1=C(C=CC(=C1)OCCCC(=O)O)CCCCCCO

InChI

InChI=1S/C20H28O6/c1-25-20(24)12-10-17-15-18(26-14-6-8-19(22)23)11-9-16(17)7-4-2-3-5-13-21/h9-12,15,21H,2-8,13-14H2,1H3,(H,22,23)/b12-10+