[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 1,5-dimethylpyrazole-3-carboxylate

Systemtic Name: [2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 1,5-dimethylpyrazole-3-carboxylate Openeye Name: [2-oxo-2-(p-tolylmethylamino)ethyl] 1,5-dimethylpyrazole-3-carboxylate CAS Name: 1,5-dimethyl-3-pyrazolecarboxylic acid [2-[(4-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methylphenyl)methylamino]-2-oxoethyl] 1,5-dimethylpyrazole-3-carboxylate Traditional Name: 1,5-dimethylpyrazole-3-carboxylic acid [2-keto-2-[(4-methylbenzyl)amino]ethyl] ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)COC(=O)C2=NN(C(=C2)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)COC(=O)C2=NN(C(=C2)C)C

InChI

InChI=1S/C16H19N3O3/c1-11-4-6-13(7-5-11)9-17-15(20)10-22-16(21)14-8-12(2)19(3)18-14/h4-8H,9-10H2,1-3H3,(H,17,20)