3-[2,6-dicyano-3,4-bis(oxidanyl)phenyl]propanoic acid

Systemtic Name: 3-[2,6-dicyano-3,4-bis(oxidanyl)phenyl]propanoic acid Openeye Name: 3-(2,6-dicyano-3,4-dihydroxy-phenyl)propanoic acid CAS Name: 3-(2,6-dicyano-3,4-dihydroxyphenyl)propanoic acid IUPAC Name: 3-(2,6-dicyano-3,4-dihydroxyphenyl)propanoic acid Traditional Name: 3-(2,6-dicyano-3,4-dihydroxy-phenyl)propionic acid Formula: C11H8N2O4 MolecularWeight: 232.19222

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1O)O)C#N)CCC(=O)O)C#N

Isomeric SMILES

C1=C(C(=C(C(=C1O)O)C#N)CCC(=O)O)C#N

InChI

InChI=1S/C11H8N2O4/c12-4-6-3-9(14)11(17)8(5-13)7(6)1-2-10(15)16/h3,14,17H,1-2H2,(H,15,16)