methyl 3-(3-chlorophenyl)-1-(2-cyanoethyl)pyrazole-4-carboxylate

Systemtic Name: methyl 3-(3-chlorophenyl)-1-(2-cyanoethyl)pyrazole-4-carboxylate Openeye Name: methyl 3-(3-chlorophenyl)-1-(2-cyanoethyl)pyrazole-4-carboxylate CAS Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-chlorophenyl)-1-(2-cyanoethyl)pyrazole-4-carboxylate Traditional Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)pyrazole-4-carboxylic acid methyl ester Formula: C14H12ClN3O2 MolecularWeight: 289.71698

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=C1C2=CC(=CC=C2)Cl)CCC#N

Isomeric SMILES

COC(=O)C1=CN(N=C1C2=CC(=CC=C2)Cl)CCC#N

InChI

InChI=1S/C14H12ClN3O2/c1-20-14(19)12-9-18(7-3-6-16)17-13(12)10-4-2-5-11(15)8-10/h2,4-5,8-9H,3,7H2,1H3