methyl 2-[2-(4-hydroxyphenyl)carbonyl-3,5-bis(oxidanyl)phenyl]butanoate

Systemtic Name: methyl 2-[2-(4-hydroxyphenyl)carbonyl-3,5-bis(oxidanyl)phenyl]butanoate Openeye Name: methyl 2-[3,5-dihydroxy-2-(4-hydroxybenzoyl)phenyl]butanoate CAS Name: 2-[3,5-dihydroxy-2-[(4-hydroxyphenyl)-oxomethyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 2-[3,5-dihydroxy-2-(4-hydroxybenzoyl)phenyl]butanoate Traditional Name: 2-[3,5-dihydroxy-2-(4-hydroxybenzoyl)phenyl]butyric acid methyl ester Formula: C18H18O6 MolecularWeight: 330.33192

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC(=C1C(=O)C2=CC=C(C=C2)O)O)O)C(=O)OC

Isomeric SMILES

CCC(C1=CC(=CC(=C1C(=O)C2=CC=C(C=C2)O)O)O)C(=O)OC

InChI

InChI=1S/C18H18O6/c1-3-13(18(23)24-2)14-8-12(20)9-15(21)16(14)17(22)10-4-6-11(19)7-5-10/h4-9,13,19-21H,3H2,1-2H3