2-[1,1-bis(oxidanyl)butyl]terephthalic acid

Systemtic Name: 2-[1,1-bis(oxidanyl)butyl]terephthalic acid Openeye Name: 2-(1,1-dihydroxybutyl)terephthalic acid CAS Name: 2-(1,1-dihydroxybutyl)terephthalic acid IUPAC Name: 2-(1,1-dihydroxybutyl)terephthalic acid Traditional Name: 2-(1,1-dihydroxybutyl)terephthalic acid Formula: C12H14O6 MolecularWeight: 254.23596

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=CC(=C1)C(=O)O)C(=O)O)(O)O

Isomeric SMILES

CCCC(C1=C(C=CC(=C1)C(=O)O)C(=O)O)(O)O

InChI

InChI=1S/C12H14O6/c1-2-5-12(17,18)9-6-7(10(13)14)3-4-8(9)11(15)16/h3-4,6,17-18H,2,5H2,1H3,(H,13,14)(H,15,16)