2-[[2-(2-carboxy-5-oxidanyl-5-oxidanylidene-pentyl)phenyl]methyl]pentanedioic acid

Systemtic Name: 2-[[2-(2-carboxy-5-oxidanyl-5-oxidanylidene-pentyl)phenyl]methyl]pentanedioic acid Openeye Name: 2-[[2-(2-carboxy-5-hydroxy-5-oxo-pentyl)phenyl]methyl]pentanedioic acid CAS Name: 2-[[2-(2-carboxy-5-hydroxy-5-oxopentyl)phenyl]methyl]pentanedioic acid IUPAC Name: 2-[[2-(2-carboxy-5-hydroxy-5-oxopentyl)phenyl]methyl]pentanedioic acid Traditional Name: 2-[2-(2-carboxy-5-hydroxy-5-keto-pentyl)benzyl]glutaric acid Formula: C18H22O8 MolecularWeight: 366.36248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(CCC(=O)O)C(=O)O)CC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CC(CCC(=O)O)C(=O)O)CC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C18H22O8/c19-15(20)7-5-13(17(23)24)9-11-3-1-2-4-12(11)10-14(18(25)26)6-8-16(21)22/h1-4,13-14H,5-10H2,(H,19,20)(H,21,22)(H,23,24)(H,25,26)