3-[4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]-3-oxidanyl-phenyl]carbonylbenzoic acid

Systemtic Name: 3-[4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]-3-oxidanyl-phenyl]carbonylbenzoic acid Openeye Name: 3-[3-hydroxy-4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]benzoyl]benzoic acid CAS Name: 3-[[3-hydroxy-4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]phenyl]-oxomethyl]benzoic acid IUPAC Name: 3-[3-hydroxy-4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]benzoyl]benzoic acid Traditional Name: 3-[3-hydroxy-4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]benzoyl]benzoic acid Formula: C27H26O6 MolecularWeight: 446.49174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CCCCCOC2=C(C=C(C=C2)C(=O)C3=CC(=CC=C3)C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/CCCCOC2=C(C=C(C=C2)C(=O)C3=CC(=CC=C3)C(=O)O)O

InChI

InChI=1S/C27H26O6/c1-32-23-13-10-19(11-14-23)7-4-2-3-5-16-33-25-15-12-21(18-24(25)28)26(29)20-8-6-9-22(17-20)27(30)31/h4,6-15,17-18,28H,2-3,5,16H2,1H3,(H,30,31)/b7-4+