3-[(2,6-dimethylphenyl)amino]-5-methyl-1H-pyrazole-4-carboxylic acid

Systemtic Name: 3-[(2,6-dimethylphenyl)amino]-5-methyl-1H-pyrazole-4-carboxylic acid Openeye Name: 3-(2,6-dimethylanilino)-5-methyl-1H-pyrazole-4-carboxylic acid CAS Name: 3-(2,6-dimethylanilino)-5-methyl-1H-pyrazole-4-carboxylic acid IUPAC Name: 3-(2,6-dimethylanilino)-5-methyl-1H-pyrazole-4-carboxylic acid Traditional Name: 3-(2,6-dimethylanilino)-5-methyl-1H-pyrazole-4-carboxylic acid Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NNC(=C2C(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NNC(=C2C(=O)O)C

InChI

InChI=1S/C13H15N3O2/c1-7-5-4-6-8(2)11(7)14-12-10(13(17)18)9(3)15-16-12/h4-6H,1-3H3,(H,17,18)(H2,14,15,16)