3-[2-(3-carboxyphenyl)-1,2-bis(oxidanyl)ethyl]benzoic acid

Systemtic Name: 3-[2-(3-carboxyphenyl)-1,2-bis(oxidanyl)ethyl]benzoic acid Openeye Name: 3-[2-(3-carboxyphenyl)-1,2-dihydroxy-ethyl]benzoic acid CAS Name: 3-[2-(3-carboxyphenyl)-1,2-dihydroxyethyl]benzoic acid IUPAC Name: 3-[2-(3-carboxyphenyl)-1,2-dihydroxyethyl]benzoic acid Traditional Name: 3-[2-(3-carboxyphenyl)-1,2-dihydroxy-ethyl]benzoic acid Formula: C16H14O6 MolecularWeight: 302.27876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(C(C2=CC=CC(=C2)C(=O)O)O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(C(C2=CC=CC(=C2)C(=O)O)O)O)C(=O)O

InChI

InChI=1S/C16H14O6/c17-13(9-3-1-5-11(7-9)15(19)20)14(18)10-4-2-6-12(8-10)16(21)22/h1-8,13-14,17-18H,(H,19,20)(H,21,22)