2,3-bis[[3,4,5-tris(oxidanyl)phenyl]carbonyloxy]butanedioic acid

Systemtic Name: 2,3-bis[[3,4,5-tris(oxidanyl)phenyl]carbonyloxy]butanedioic acid Openeye Name: 2,3-bis[(3,4,5-trihydroxybenzoyl)oxy]butanedioic acid CAS Name: 2,3-bis[oxo-(3,4,5-trihydroxyphenyl)methoxy]butanedioic acid IUPAC Name: 2,3-bis[(3,4,5-trihydroxybenzoyl)oxy]butanedioic acid Traditional Name: 2,3-digalloyloxysuccinic acid Formula: C18H14O14 MolecularWeight: 454.29536

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1O)O)O)C(=O)OC(C(C(=O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)C(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1O)O)O)C(=O)OC(C(C(=O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)C(=O)O

InChI

InChI=1S/C18H14O14/c19-7-1-5(2-8(20)11(7)23)17(29)31-13(15(25)26)14(16(27)28)32-18(30)6-3-9(21)12(24)10(22)4-6/h1-4,13-14,19-24H,(H,25,26)(H,27,28)