butyl 5-[4-chloranyl-2-(methoxymethoxy)phenyl]-1H-pyrazole-4-carboxylate

Systemtic Name: butyl 5-[4-chloranyl-2-(methoxymethoxy)phenyl]-1H-pyrazole-4-carboxylate Openeye Name: butyl 5-[4-chloro-2-(methoxymethoxy)phenyl]-1H-pyrazole-4-carboxylate CAS Name: 5-[4-chloro-2-(methoxymethoxy)phenyl]-1H-pyrazole-4-carboxylic acid butyl ester IUPAC Name: butyl 5-[4-chloro-2-(methoxymethoxy)phenyl]-1H-pyrazole-4-carboxylate Traditional Name: 5-[4-chloro-2-(methoxymethoxy)phenyl]-1H-pyrazole-4-carboxylic acid butyl ester Formula: C16H19ClN2O4 MolecularWeight: 338.78606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NN=C1)C2=C(C=C(C=C2)Cl)OCOC

Isomeric SMILES

CCCCOC(=O)C1=C(NN=C1)C2=C(C=C(C=C2)Cl)OCOC

InChI

InChI=1S/C16H19ClN2O4/c1-3-4-7-22-16(20)13-9-18-19-15(13)12-6-5-11(17)8-14(12)23-10-21-2/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,18,19)