[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate

Systemtic Name: [2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate Openeye Name: [2-(4-methylanilino)-2-oxo-ethyl] 1-methylpyrazole-4-carboxylate CAS Name: 1-methyl-4-pyrazolecarboxylic acid [2-(4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methylanilino)-2-oxoethyl] 1-methylpyrazole-4-carboxylate Traditional Name: 1-methylpyrazole-4-carboxylic acid [2-keto-2-(p-toluidino)ethyl] ester Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)COC(=O)C2=CN(N=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)COC(=O)C2=CN(N=C2)C

InChI

InChI=1S/C14H15N3O3/c1-10-3-5-12(6-4-10)16-13(18)9-20-14(19)11-7-15-17(2)8-11/h3-8H,9H2,1-2H3,(H,16,18)