methyl 4-cyano-1-(4-methylphenyl)pyrazole-3-carboxylate

Systemtic Name: methyl 4-cyano-1-(4-methylphenyl)pyrazole-3-carboxylate Openeye Name: methyl 4-cyano-1-(p-tolyl)pyrazole-3-carboxylate CAS Name: 4-cyano-1-(4-methylphenyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-1-(4-methylphenyl)pyrazole-3-carboxylate Traditional Name: 4-cyano-1-(p-tolyl)pyrazole-3-carboxylic acid methyl ester Formula: C13H11N3O2 MolecularWeight: 241.24534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O2/c1-9-3-5-11(6-4-9)16-8-10(7-14)12(15-16)13(17)18-2/h3-6,8H,1-2H3