3-[1,3-bis(oxidanyl)propyl]benzoic acid

Systemtic Name: 3-[1,3-bis(oxidanyl)propyl]benzoic acid Openeye Name: 3-(1,3-dihydroxypropyl)benzoic acid CAS Name: 3-(1,3-dihydroxypropyl)benzoic acid IUPAC Name: 3-(1,3-dihydroxypropyl)benzoic acid Traditional Name: 3-(1,3-dihydroxypropyl)benzoic acid Formula: C10H12O4 MolecularWeight: 196.19988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(CCO)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(CCO)O)C(=O)O

InChI

InChI=1S/C10H12O4/c11-5-4-9(12)7-2-1-3-8(6-7)10(13)14/h1-3,6,9,11-12H,4-5H2,(H,13,14)