[4-[bis(fluoranyl)methoxy]-3-chloranyl-5-methoxy-phenyl]methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [4-[bis(fluoranyl)methoxy]-3-chloranyl-5-methoxy-phenyl]methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [3-chloro-4-(difluoromethoxy)-5-methoxy-phenyl]methyl 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid [3-chloro-4-(difluoromethoxy)-5-methoxyphenyl]methyl ester IUPAC Name: [3-chloro-4-(difluoromethoxy)-5-methoxyphenyl]methyl 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid [3-chloro-4-(difluoromethoxy)-5-methoxy-benzyl] ester Formula: C20H17ClF2N2O5 MolecularWeight: 438.809186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC(=C(C(=C3)Cl)OC(F)F)OC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC(=C(C(=C3)Cl)OC(F)F)OC

InChI

InChI=1S/C20H17ClF2N2O5/c1-3-25-18(26)13-7-5-4-6-12(13)16(24-25)19(27)29-10-11-8-14(21)17(30-20(22)23)15(9-11)28-2/h4-9,20H,3,10H2,1-2H3