ethyl 3-(chloromethyl)-5-methyl-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 3-(chloromethyl)-5-methyl-1H-pyrazole-4-carboxylate Openeye Name: ethyl 3-(chloromethyl)-5-methyl-1H-pyrazole-4-carboxylate CAS Name: 3-(chloromethyl)-5-methyl-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(chloromethyl)-5-methyl-1H-pyrazole-4-carboxylate Traditional Name: 3-(chloromethyl)-5-methyl-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C8H11ClN2O2 MolecularWeight: 202.63814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1CCl)C

Isomeric SMILES

CCOC(=O)C1=C(NN=C1CCl)C

InChI

InChI=1S/C8H11ClN2O2/c1-3-13-8(12)7-5(2)10-11-6(7)4-9/h3-4H2,1-2H3,(H,10,11)