(3-cyanophenyl)methyl 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate Openeye Name: (3-cyanophenyl)methyl 5-chloro-1,3-dimethyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1,3-dimethyl-4-pyrazolecarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 5-chloro-1,3-dimethylpyrazole-4-carboxylate Traditional Name: 5-chloro-1,3-dimethyl-pyrazole-4-carboxylic acid (3-cyanobenzyl) ester Formula: C14H12ClN3O2 MolecularWeight: 289.71698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC2=CC=CC(=C2)C#N)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC2=CC=CC(=C2)C#N)Cl)C

InChI

InChI=1S/C14H12ClN3O2/c1-9-12(13(15)18(2)17-9)14(19)20-8-11-5-3-4-10(6-11)7-16/h3-6H,8H2,1-2H3