[2-oxidanylidene-2-(propylamino)ethyl] 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: [2-oxo-2-(propylamino)ethyl] 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 3,5-dimethyl-1-phenyl-4-pyrazolecarboxylic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] 3,5-dimethyl-1-phenylpyrazole-4-carboxylate Traditional Name: 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylic acid [2-keto-2-(propylamino)ethyl] ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C1=C(N(N=C1C)C2=CC=CC=C2)C

Isomeric SMILES

CCCNC(=O)COC(=O)C1=C(N(N=C1C)C2=CC=CC=C2)C

InChI

InChI=1S/C17H21N3O3/c1-4-10-18-15(21)11-23-17(22)16-12(2)19-20(13(16)3)14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3,(H,18,21)