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

Systemtic Name: ethyl 1-[4-[bis(fluoranyl)methoxy]phenyl]-5-chloranyl-4-oxidanylidene-cinnoline-3-carboxylate Openeye Name: ethyl 5-chloro-1-[4-(difluoromethoxy)phenyl]-4-oxo-cinnoline-3-carboxylate CAS Name: 5-chloro-1-[4-(difluoromethoxy)phenyl]-4-oxo-3-cinnolinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-1-[4-(difluoromethoxy)phenyl]-4-oxocinnoline-3-carboxylate Traditional Name: 5-chloro-1-[4-(difluoromethoxy)phenyl]-4-keto-cinnoline-3-carboxylic acid ethyl ester Formula: C18H13ClF2N2O4 MolecularWeight: 394.756626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C(C1=O)C(=CC=C2)Cl)C3=CC=C(C=C3)OC(F)F

Isomeric SMILES

CCOC(=O)C1=NN(C2=C(C1=O)C(=CC=C2)Cl)C3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C18H13ClF2N2O4/c1-2-26-17(25)15-16(24)14-12(19)4-3-5-13(14)23(22-15)10-6-8-11(9-7-10)27-18(20)21/h3-9,18H,2H2,1H3