2-oxidanyl-5-[3-(1,2,4-triazol-1-yl)propanoylamino]benzoic acid

Systemtic Name: 2-oxidanyl-5-[3-(1,2,4-triazol-1-yl)propanoylamino]benzoic acid Openeye Name: 2-hydroxy-5-[3-(1,2,4-triazol-1-yl)propanoylamino]benzoic acid CAS Name: 2-hydroxy-5-[[1-oxo-3-(1,2,4-triazol-1-yl)propyl]amino]benzoic acid IUPAC Name: 2-hydroxy-5-[3-(1,2,4-triazol-1-yl)propanoylamino]benzoic acid Traditional Name: 2-hydroxy-5-[3-(1,2,4-triazol-1-yl)propanoylamino]benzoic acid Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCN2C=NC=N2)C(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCN2C=NC=N2)C(=O)O)O

InChI

InChI=1S/C12H12N4O4/c17-10-2-1-8(5-9(10)12(19)20)15-11(18)3-4-16-7-13-6-14-16/h1-2,5-7,17H,3-4H2,(H,15,18)(H,19,20)