3-(2-imidazol-1-ylethanoyl)-4-oxidanyl-benzoic acid

Systemtic Name: 3-(2-imidazol-1-ylethanoyl)-4-oxidanyl-benzoic acid Openeye Name: 4-hydroxy-3-(2-imidazol-1-ylacetyl)benzoic acid CAS Name: 4-hydroxy-3-[2-(1-imidazolyl)-1-oxoethyl]benzoic acid IUPAC Name: 4-hydroxy-3-(2-imidazol-1-ylacetyl)benzoic acid Traditional Name: 4-hydroxy-3-(2-imidazol-1-ylacetyl)benzoic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)C(=O)CN2C=CN=C2)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)C(=O)CN2C=CN=C2)O

InChI

InChI=1S/C12H10N2O4/c15-10-2-1-8(12(17)18)5-9(10)11(16)6-14-4-3-13-7-14/h1-5,7,15H,6H2,(H,17,18)