3-[(4-chloranyl-2-methyl-phenyl)amino]-5-methyl-1H-pyrazole-4-carboxylic acid

Systemtic Name: 3-[(4-chloranyl-2-methyl-phenyl)amino]-5-methyl-1H-pyrazole-4-carboxylic acid Openeye Name: 3-(4-chloro-2-methyl-anilino)-5-methyl-1H-pyrazole-4-carboxylic acid CAS Name: 3-(4-chloro-2-methylanilino)-5-methyl-1H-pyrazole-4-carboxylic acid IUPAC Name: 3-(4-chloro-2-methylanilino)-5-methyl-1H-pyrazole-4-carboxylic acid Traditional Name: 3-(4-chloro-2-methyl-anilino)-5-methyl-1H-pyrazole-4-carboxylic acid Formula: C12H12ClN3O2 MolecularWeight: 265.69558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClN3O2/c1-6-5-8(13)3-4-9(6)14-11-10(12(17)18)7(2)15-16-11/h3-5H,1-2H3,(H,17,18)(H2,14,15,16)