5-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 5-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-1,2,4-triazole-3-carboxylic acid CAS Name: 5-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-1,2,4-triazole-3-carboxylic acid Formula: C17H14ClN3O2 MolecularWeight: 327.76496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NC(=N2)C(=O)O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NC(=N2)C(=O)O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C17H14ClN3O2/c1-10-3-8-14(9-11(10)2)21-16(19-15(20-21)17(22)23)12-4-6-13(18)7-5-12/h3-9H,1-2H3,(H,22,23)