ethyl 5-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]carbamoyl]-2-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]carbamoyl]-2-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]carbamoyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]carbamoyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]carbamoyl]-2-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C14H19N3O5 MolecularWeight: 309.31776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(=O)C1=NN(C(=C1)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(=O)C1=NN(C(=C1)C(=O)OCC)C

InChI

InChI=1S/C14H19N3O5/c1-5-21-12(18)7-9(3)15-13(19)10-8-11(17(4)16-10)14(20)22-6-2/h7-8H,5-6H2,1-4H3,(H,15,19)/b9-7+