2-chloranyl-5-(1H-1,2,4-triazol-5-ylcarbonylamino)benzoic acid

Systemtic Name: 2-chloranyl-5-(1H-1,2,4-triazol-5-ylcarbonylamino)benzoic acid Openeye Name: 2-chloro-5-(1H-1,2,4-triazole-5-carbonylamino)benzoic acid CAS Name: 2-chloro-5-[[oxo(1H-1,2,4-triazol-5-yl)methyl]amino]benzoic acid IUPAC Name: 2-chloro-5-(1H-1,2,4-triazole-5-carbonylamino)benzoic acid Traditional Name: 2-chloro-5-(1H-1,2,4-triazole-5-carbonylamino)benzoic acid Formula: C10H7ClN4O3 MolecularWeight: 266.64058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C2=NC=NN2)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)C2=NC=NN2)C(=O)O)Cl

InChI

InChI=1S/C10H7ClN4O3/c11-7-2-1-5(3-6(7)10(17)18)14-9(16)8-12-4-13-15-8/h1-4H,(H,14,16)(H,17,18)(H,12,13,15)