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

Systemtic Name: 5-chloranyl-2-(1,2,4-triazol-4-yl)benzoic acid Openeye Name: 5-chloro-2-(1,2,4-triazol-4-yl)benzoic acid CAS Name: 5-chloro-2-(1,2,4-triazol-4-yl)benzoic acid IUPAC Name: 5-chloro-2-(1,2,4-triazol-4-yl)benzoic acid Traditional Name: 5-chloro-2-(1,2,4-triazol-4-yl)benzoic acid Formula: C9H6ClN3O2 MolecularWeight: 223.61584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)C(=O)O)N2C=NN=C2

Isomeric SMILES

C1=CC(=C(C=C1Cl)C(=O)O)N2C=NN=C2

InChI

InChI=1S/C9H6ClN3O2/c10-6-1-2-8(7(3-6)9(14)15)13-4-11-12-5-13/h1-5H,(H,14,15)