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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)OCC2=CC=C(C=C2)C#N)Cl

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)OCC2=CC=C(C=C2)C#N)Cl

InChI

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