propan-2-yl 4-[[5-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]furan-2-yl]carbonylamino]-1-ethyl-pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 4-[[5-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]furan-2-yl]carbonylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: isopropyl 4-[[5-[(2-chloro-4-fluoro-phenoxy)methyl]furan-2-carbonyl]amino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[[5-[(2-chloro-4-fluorophenoxy)methyl]-2-furanyl]-oxomethyl]amino]-1-ethyl-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[5-[(2-chloro-4-fluorophenoxy)methyl]furan-2-carbonyl]amino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[[5-[(2-chloro-4-fluoro-phenoxy)methyl]-2-furoyl]amino]-1-ethyl-pyrazole-3-carboxylic acid isopropyl ester Formula: C21H21ClFN3O5 MolecularWeight: 449.859943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC=C(O2)COC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC=C(O2)COC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C21H21ClFN3O5/c1-4-26-10-16(19(25-26)21(28)30-12(2)3)24-20(27)18-8-6-14(31-18)11-29-17-7-5-13(23)9-15(17)22/h5-10,12H,4,11H2,1-3H3,(H,24,27)