cyanomethyl 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate

Systemtic Name: cyanomethyl 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate Openeye Name: cyanomethyl 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-4-pyrazolecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate Traditional Name: 1-(2-chlorobenzyl)pyrazole-4-carboxylic acid cyanomethyl ester Formula: C13H10ClN3O2 MolecularWeight: 275.6904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=N2)C(=O)OCC#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=N2)C(=O)OCC#N)Cl

InChI

InChI=1S/C13H10ClN3O2/c14-12-4-2-1-3-10(12)8-17-9-11(7-16-17)13(18)19-6-5-15/h1-4,7,9H,6,8H2