[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(1-phenylpyrazol-4-yl)propanoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(1-phenylpyrazol-4-yl)propanoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] 3-(1-phenylpyrazol-4-yl)propanoate CAS Name: 3-(1-phenyl-4-pyrazolyl)propanoic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] 3-(1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(1-phenylpyrazol-4-yl)propionic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)COC(=O)CCC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CNC(=O)NC(=O)COC(=O)CCC1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H18N4O4/c1-17-16(23)19-14(21)11-24-15(22)8-7-12-9-18-20(10-12)13-5-3-2-4-6-13/h2-6,9-10H,7-8,11H2,1H3,(H2,17,19,21,23)