ethyl (E)-3-(5-azanyl-2-ethanoyl-3-oxidanylidene-1H-pyrazol-4-yl)-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-(5-azanyl-2-ethanoyl-3-oxidanylidene-1H-pyrazol-4-yl)-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-(2-acetyl-5-amino-3-oxo-1H-pyrazol-4-yl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(2-acetyl-5-amino-3-oxo-1H-pyrazol-4-yl)-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(2-acetyl-5-amino-3-oxo-1H-pyrazol-4-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(1-acetyl-3-amino-5-keto-3-pyrazolin-4-yl)-2-cyano-acrylic acid ethyl ester Formula: C11H12N4O4 MolecularWeight: 264.23738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(NN(C1=O)C(=O)C)N)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(NN(C1=O)C(=O)C)N)/C#N

InChI

InChI=1S/C11H12N4O4/c1-3-19-11(18)7(5-12)4-8-9(13)14-15(6(2)16)10(8)17/h4,14H,3,13H2,1-2H3/b7-4+