3-[3,4-bis(oxidanyl)phenyl]oxirane-2-carboxylic acid

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]oxirane-2-carboxylic acid Openeye Name: 3-(3,4-dihydroxyphenyl)oxirane-2-carboxylic acid CAS Name: 3-(3,4-dihydroxyphenyl)-2-oxiranecarboxylic acid IUPAC Name: 3-(3,4-dihydroxyphenyl)oxirane-2-carboxylic acid Traditional Name: 3-(3,4-dihydroxyphenyl)oxirane-2-carboxylic acid Formula: C9H8O5 MolecularWeight: 196.15682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2C(O2)C(=O)O)O)O

Isomeric SMILES

C1=CC(=C(C=C1C2C(O2)C(=O)O)O)O

InChI

InChI=1S/C9H8O5/c10-5-2-1-4(3-6(5)11)7-8(14-7)9(12)13/h1-3,7-8,10-11H,(H,12,13)