methyl 3-cyano-2-(4-methylphenyl)-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: methyl 3-cyano-2-(4-methylphenyl)-3,4-dihydropyrazole-5-carboxylate Openeye Name: methyl 3-cyano-2-(p-tolyl)-3,4-dihydropyrazole-5-carboxylate CAS Name: 3-cyano-2-(4-methylphenyl)-3,4-dihydropyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-cyano-2-(4-methylphenyl)-3,4-dihydropyrazole-5-carboxylate Traditional Name: 5-cyano-1-(p-tolyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C13H13N3O2 MolecularWeight: 243.26122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(CC(=N2)C(=O)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(CC(=N2)C(=O)OC)C#N

InChI

InChI=1S/C13H13N3O2/c1-9-3-5-10(6-4-9)16-11(8-14)7-12(15-16)13(17)18-2/h3-6,11H,7H2,1-2H3