2-acetamido-4-(1,2,4-triazol-4-yl)benzoic acid

Systemtic Name: 2-acetamido-4-(1,2,4-triazol-4-yl)benzoic acid Openeye Name: 2-acetamido-4-(1,2,4-triazol-4-yl)benzoic acid CAS Name: 2-acetamido-4-(1,2,4-triazol-4-yl)benzoic acid IUPAC Name: 2-acetamido-4-(1,2,4-triazol-4-yl)benzoic acid Traditional Name: 2-acetamido-4-(1,2,4-triazol-4-yl)benzoic acid Formula: C11H10N4O3 MolecularWeight: 246.2221

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)N2C=NN=C2)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)N2C=NN=C2)C(=O)O

InChI

InChI=1S/C11H10N4O3/c1-7(16)14-10-4-8(15-5-12-13-6-15)2-3-9(10)11(17)18/h2-6H,1H3,(H,14,16)(H,17,18)