methyl 5-benzamido-4-cyano-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: methyl 5-benzamido-4-cyano-3,4-dihydropyrazole-5-carboxylate Openeye Name: methyl 5-benzamido-4-cyano-3,4-dihydropyrazole-5-carboxylate CAS Name: 5-benzamido-4-cyano-3,4-dihydropyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 5-benzamido-4-cyano-3,4-dihydropyrazole-5-carboxylate Traditional Name: 3-benzamido-4-cyano-1-pyrazoline-3-carboxylic acid methyl ester Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C(CN=N1)C#N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1(C(CN=N1)C#N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H12N4O3/c1-20-12(19)13(10(7-14)8-15-17-13)16-11(18)9-5-3-2-4-6-9/h2-6,10H,8H2,1H3,(H,16,18)