methyl 2-cyano-3-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-3-pyridin-3-yl-propanoate

Systemtic Name: methyl 2-cyano-3-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-3-pyridin-3-yl-propanoate Openeye Name: methyl 2-cyano-3-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-3-(3-pyridyl)propanoate CAS Name: 2-cyano-3-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-3-(3-pyridinyl)propanoic acid methyl ester IUPAC Name: methyl 2-cyano-3-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-3-pyridin-3-ylpropanoate Traditional Name: 2-cyano-3-(3-keto-5-methyl-3-pyrazolin-4-yl)-3-(3-pyridyl)propionic acid methyl ester Formula: C14H14N4O3 MolecularWeight: 286.28596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C(C2=CN=CC=C2)C(C#N)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)NN1)C(C2=CN=CC=C2)C(C#N)C(=O)OC

InChI

InChI=1S/C14H14N4O3/c1-8-11(13(19)18-17-8)12(9-4-3-5-16-7-9)10(6-15)14(20)21-2/h3-5,7,10,12H,1-2H3,(H2,17,18,19)