1-[(2,6-dimethylphenyl)amino]pyrazole-4-carboxylic acid

Systemtic Name: 1-[(2,6-dimethylphenyl)amino]pyrazole-4-carboxylic acid Openeye Name: 1-(2,6-dimethylanilino)pyrazole-4-carboxylic acid CAS Name: 1-(2,6-dimethylanilino)-4-pyrazolecarboxylic acid IUPAC Name: 1-(2,6-dimethylanilino)pyrazole-4-carboxylic acid Traditional Name: 1-(2,6-dimethylanilino)pyrazole-4-carboxylic acid Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NN2C=C(C=N2)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C12H13N3O2/c1-8-4-3-5-9(2)11(8)14-15-7-10(6-13-15)12(16)17/h3-7,14H,1-2H3,(H,16,17)