1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 1-[2-(4-chloroanilino)-2-oxo-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid CAS Name: 1-[2-(4-chloroanilino)-2-oxoethyl]-3,5-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-[2-(4-chloroanilino)-2-oxoethyl]-3,5-dimethylpyrazole-4-carboxylic acid Traditional Name: 1-[2-(4-chloroanilino)-2-keto-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C14H14ClN3O3 MolecularWeight: 307.73226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)Cl)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)Cl)C)C(=O)O

InChI

InChI=1S/C14H14ClN3O3/c1-8-13(14(20)21)9(2)18(17-8)7-12(19)16-11-5-3-10(15)4-6-11/h3-6H,7H2,1-2H3,(H,16,19)(H,20,21)