methyl 4-[4,5-bis(chloranyl)-1-ethyl-pyrazol-3-yl]carbonylbenzoate

Systemtic Name: methyl 4-[4,5-bis(chloranyl)-1-ethyl-pyrazol-3-yl]carbonylbenzoate Openeye Name: methyl 4-(4,5-dichloro-1-ethyl-pyrazole-3-carbonyl)benzoate CAS Name: 4-[(4,5-dichloro-1-ethyl-3-pyrazolyl)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-(4,5-dichloro-1-ethylpyrazole-3-carbonyl)benzoate Traditional Name: 4-(4,5-dichloro-1-ethyl-pyrazole-3-carbonyl)benzoic acid methyl ester Formula: C14H12Cl2N2O3 MolecularWeight: 327.16268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C(=O)C2=CC=C(C=C2)C(=O)OC)Cl)Cl

Isomeric SMILES

CCN1C(=C(C(=N1)C(=O)C2=CC=C(C=C2)C(=O)OC)Cl)Cl

InChI

InChI=1S/C14H12Cl2N2O3/c1-3-18-13(16)10(15)11(17-18)12(19)8-4-6-9(7-5-8)14(20)21-2/h4-7H,3H2,1-2H3