[2-(2-cyanoethyl)-5-methyl-pyrazol-3-yl] 2-chloranylbenzoate

Systemtic Name: [2-(2-cyanoethyl)-5-methyl-pyrazol-3-yl] 2-chloranylbenzoate Openeye Name: [2-(2-cyanoethyl)-5-methyl-pyrazol-3-yl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [2-(2-cyanoethyl)-5-methyl-3-pyrazolyl] ester IUPAC Name: [2-(2-cyanoethyl)-5-methylpyrazol-3-yl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [2-(2-cyanoethyl)-5-methyl-pyrazol-3-yl] ester Formula: C14H12ClN3O2 MolecularWeight: 289.71698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)OC(=O)C2=CC=CC=C2Cl)CCC#N

Isomeric SMILES

CC1=NN(C(=C1)OC(=O)C2=CC=CC=C2Cl)CCC#N

InChI

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