(E)-6-[3-methoxy-5-[(E)-6-oxidanyl-6-oxidanylidene-hex-1-enyl]phenyl]hex-5-enoic acid

Systemtic Name: (E)-6-[3-methoxy-5-[(E)-6-oxidanyl-6-oxidanylidene-hex-1-enyl]phenyl]hex-5-enoic acid Openeye Name: (E)-6-[3-[(E)-6-hydroxy-6-oxo-hex-1-enyl]-5-methoxy-phenyl]hex-5-enoic acid CAS Name: (E)-6-[3-[(E)-6-hydroxy-6-oxohex-1-enyl]-5-methoxyphenyl]-5-hexenoic acid IUPAC Name: (E)-6-[3-[(E)-6-hydroxy-6-oxohex-1-enyl]-5-methoxyphenyl]hex-5-enoic acid Traditional Name: (E)-6-[3-[(E)-6-hydroxy-6-keto-hex-1-enyl]-5-methoxy-phenyl]hex-5-enoic acid Formula: C19H24O5 MolecularWeight: 332.39086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=CCCCC(=O)O)C=CCCCC(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1)/C=C/CCCC(=O)O)/C=C/CCCC(=O)O

InChI

InChI=1S/C19H24O5/c1-24-17-13-15(8-4-2-6-10-18(20)21)12-16(14-17)9-5-3-7-11-19(22)23/h4-5,8-9,12-14H,2-3,6-7,10-11H2,1H3,(H,20,21)(H,22,23)/b8-4+,9-5+