ethyl 5-(chloromethyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(chloromethyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(chloromethyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-(chloromethyl)-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(chloromethyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-(chloromethyl)-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C13H13ClN2O2 MolecularWeight: 264.70752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)CCl

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)CCl

InChI

InChI=1S/C13H13ClN2O2/c1-2-18-13(17)11-9-15-16(12(11)8-14)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3