5-oxidanyl-2,4-bis(2-oxidanyl-4-oxidanylidene-hex-5-enyl)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-oxidanyl-2,4-bis(2-oxidanyl-4-oxidanylidene-hex-5-enyl)benzene-1,3-dicarboxylic acid Openeye Name: 5-hydroxy-2,4-bis(2-hydroxy-4-oxo-hex-5-enyl)benzene-1,3-dicarboxylic acid CAS Name: 5-hydroxy-2,4-bis(2-hydroxy-4-oxohex-5-enyl)benzene-1,3-dicarboxylic acid IUPAC Name: 5-hydroxy-2,4-bis(2-hydroxy-4-oxohex-5-enyl)benzene-1,3-dicarboxylic acid Traditional Name: 5-hydroxy-2,4-bis(2-hydroxy-4-keto-hex-5-enyl)isophthalic acid Formula: C20H22O9 MolecularWeight: 406.38328

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)CC(CC1=C(C(=C(C=C1C(=O)O)O)CC(CC(=O)C=C)O)C(=O)O)O

Isomeric SMILES

C=CC(=O)CC(CC1=C(C(=C(C=C1C(=O)O)O)CC(CC(=O)C=C)O)C(=O)O)O

InChI

InChI=1S/C20H22O9/c1-3-10(21)5-12(23)7-14-15(19(26)27)9-17(25)16(18(14)20(28)29)8-13(24)6-11(22)4-2/h3-4,9,12-13,23-25H,1-2,5-8H2,(H,26,27)(H,28,29)