[1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 5-propyl-1H-pyrazole-3-carboxylate

Systemtic Name: [1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 5-propyl-1H-pyrazole-3-carboxylate Openeye Name: [1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl] 5-propyl-1H-pyrazole-3-carboxylate CAS Name: 5-propyl-1H-pyrazole-3-carboxylic acid [1-(methylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(methylcarbamoylamino)-1-oxopropan-2-yl] 5-propyl-1H-pyrazole-3-carboxylate Traditional Name: 5-propyl-1H-pyrazole-3-carboxylic acid [2-keto-1-methyl-2-(methylcarbamoylamino)ethyl] ester Formula: C12H18N4O4 MolecularWeight: 282.29572

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NN1)C(=O)OC(C)C(=O)NC(=O)NC

Isomeric SMILES

CCCC1=CC(=NN1)C(=O)OC(C)C(=O)NC(=O)NC

InChI

InChI=1S/C12H18N4O4/c1-4-5-8-6-9(16-15-8)11(18)20-7(2)10(17)14-12(19)13-3/h6-7H,4-5H2,1-3H3,(H,15,16)(H2,13,14,17,19)