[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrazole-3-carboxylate

Systemtic Name: [2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrazole-3-carboxylate Openeye Name: [2-(4-methylanilino)-2-oxo-ethyl] 4-chloro-1-methyl-pyrazole-3-carboxylate CAS Name: 4-chloro-1-methyl-3-pyrazolecarboxylic acid [2-(4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methylanilino)-2-oxoethyl] 4-chloro-1-methylpyrazole-3-carboxylate Traditional Name: 4-chloro-1-methyl-pyrazole-3-carboxylic acid [2-keto-2-(p-toluidino)ethyl] ester Formula: C14H14ClN3O3 MolecularWeight: 307.73226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)COC(=O)C2=NN(C=C2Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)COC(=O)C2=NN(C=C2Cl)C

InChI

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