2-chloranyl-4-(5-methyl-1H-1,2,4-triazol-3-yl)benzoic acid

Systemtic Name: 2-chloranyl-4-(5-methyl-1H-1,2,4-triazol-3-yl)benzoic acid Openeye Name: 2-chloro-4-(5-methyl-1H-1,2,4-triazol-3-yl)benzoic acid CAS Name: 2-chloro-4-(5-methyl-1H-1,2,4-triazol-3-yl)benzoic acid IUPAC Name: 2-chloro-4-(5-methyl-1H-1,2,4-triazol-3-yl)benzoic acid Traditional Name: 2-chloro-4-(5-methyl-1H-1,2,4-triazol-3-yl)benzoic acid Formula: C10H8ClN3O2 MolecularWeight: 237.64242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)C2=CC(=C(C=C2)C(=O)O)Cl

Isomeric SMILES

CC1=NC(=NN1)C2=CC(=C(C=C2)C(=O)O)Cl

InChI

InChI=1S/C10H8ClN3O2/c1-5-12-9(14-13-5)6-2-3-7(10(15)16)8(11)4-6/h2-4H,1H3,(H,15,16)(H,12,13,14)