3-[6-(9-oxidanyl-9-oxidanylidene-nonanoyl)oxyhexoxycarbonyl]benzoic acid

Systemtic Name: 3-[6-(9-oxidanyl-9-oxidanylidene-nonanoyl)oxyhexoxycarbonyl]benzoic acid Openeye Name: 3-[6-(9-hydroxy-9-oxo-nonanoyl)oxyhexoxycarbonyl]benzoic acid CAS Name: 3-[6-(9-hydroxy-1,9-dioxononoxy)hexoxy-oxomethyl]benzoic acid IUPAC Name: 3-[6-(9-hydroxy-9-oxononanoyl)oxyhexoxycarbonyl]benzoic acid Traditional Name: 3-[6-(9-hydroxy-9-keto-nonanoyl)oxyhexoxycarbonyl]benzoic acid Formula: C23H32O8 MolecularWeight: 436.49538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OCCCCCCOC(=O)CCCCCCCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OCCCCCCOC(=O)CCCCCCCC(=O)O)C(=O)O

InChI

InChI=1S/C23H32O8/c24-20(25)13-6-2-1-3-7-14-21(26)30-15-8-4-5-9-16-31-23(29)19-12-10-11-18(17-19)22(27)28/h10-12,17H,1-9,13-16H2,(H,24,25)(H,27,28)