methyl 4-[4-[4-(4-methoxy-4-oxidanylidene-butoxy)-2-oxidanyl-phenyl]carbonyl-3-oxidanyl-phenoxy]butanoate

Systemtic Name: methyl 4-[4-[4-(4-methoxy-4-oxidanylidene-butoxy)-2-oxidanyl-phenyl]carbonyl-3-oxidanyl-phenoxy]butanoate Openeye Name: methyl 4-[3-hydroxy-4-[2-hydroxy-4-(4-methoxy-4-oxo-butoxy)benzoyl]phenoxy]butanoate CAS Name: 4-[3-hydroxy-4-[[2-hydroxy-4-(4-methoxy-4-oxobutoxy)phenyl]-oxomethyl]phenoxy]butanoic acid methyl ester IUPAC Name: methyl 4-[3-hydroxy-4-[2-hydroxy-4-(4-methoxy-4-oxobutoxy)benzoyl]phenoxy]butanoate Traditional Name: 4-[3-hydroxy-4-[2-hydroxy-4-(4-keto-4-methoxy-butoxy)benzoyl]phenoxy]butyric acid methyl ester Formula: C23H26O9 MolecularWeight: 446.44714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCOC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCCC(=O)OC)O)O

Isomeric SMILES

COC(=O)CCCOC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCCC(=O)OC)O)O

InChI

InChI=1S/C23H26O9/c1-29-21(26)5-3-11-31-15-7-9-17(19(24)13-15)23(28)18-10-8-16(14-20(18)25)32-12-4-6-22(27)30-2/h7-10,13-14,24-25H,3-6,11-12H2,1-2H3