1-(3-chloranyl-4-methyl-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid CAS Name: 1-(3-chloro-4-methylphenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid Formula: C11H10ClN3O2 MolecularWeight: 251.669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NC(=N2)C(=O)O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NC(=N2)C(=O)O)C)Cl

InChI

InChI=1S/C11H10ClN3O2/c1-6-3-4-8(5-9(6)12)15-7(2)13-10(14-15)11(16)17/h3-5H,1-2H3,(H,16,17)