[4-butanoyloxy-2,5-bis(4-hydroxyphenyl)-3,6-bis(oxidanyl)phenyl] 4-oxidanylbenzoate

Systemtic Name: [4-butanoyloxy-2,5-bis(4-hydroxyphenyl)-3,6-bis(oxidanyl)phenyl] 4-oxidanylbenzoate Openeye Name: [4-butanoyloxy-2,5-dihydroxy-3,6-bis(4-hydroxyphenyl)phenyl] 4-hydroxybenzoate CAS Name: 4-hydroxybenzoic acid [2,5-dihydroxy-3,6-bis(4-hydroxyphenyl)-4-(1-oxobutoxy)phenyl] ester IUPAC Name: [4-butanoyloxy-2,5-dihydroxy-3,6-bis(4-hydroxyphenyl)phenyl] 4-hydroxybenzoate Traditional Name: 4-hydroxybenzoic acid [4-butyryloxy-2,5-dihydroxy-3,6-bis(4-hydroxyphenyl)phenyl] ester Formula: C29H24O9 MolecularWeight: 516.49546

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C(=C(C(=C1O)C2=CC=C(C=C2)O)OC(=O)C3=CC=C(C=C3)O)O)C4=CC=C(C=C4)O

Isomeric SMILES

CCCC(=O)OC1=C(C(=C(C(=C1O)C2=CC=C(C=C2)O)OC(=O)C3=CC=C(C=C3)O)O)C4=CC=C(C=C4)O

InChI

InChI=1S/C29H24O9/c1-2-3-22(33)37-27-23(16-4-10-19(30)11-5-16)26(35)28(38-29(36)18-8-14-21(32)15-9-18)24(25(27)34)17-6-12-20(31)13-7-17/h4-15,30-32,34-35H,2-3H2,1H3