ethyl 5-oxidanylidene-3-[3-(trifluoromethyl)phenyl]-7,8-dihydro-6H-cinnoline-7-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-3-[3-(trifluoromethyl)phenyl]-7,8-dihydro-6H-cinnoline-7-carboxylate Openeye Name: ethyl 5-oxo-3-[3-(trifluoromethyl)phenyl]-7,8-dihydro-6H-cinnoline-7-carboxylate CAS Name: 5-oxo-3-[3-(trifluoromethyl)phenyl]-7,8-dihydro-6H-cinnoline-7-carboxylic acid ethyl ester IUPAC Name: ethyl 5-oxo-3-[3-(trifluoromethyl)phenyl]-7,8-dihydro-6H-cinnoline-7-carboxylate Traditional Name: 5-keto-3-[3-(trifluoromethyl)phenyl]-7,8-dihydro-6H-cinnoline-7-carboxylic acid ethyl ester Formula: C18H15F3N2O3 MolecularWeight: 364.31851

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2=NN=C(C=C2C(=O)C1)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1CC2=NN=C(C=C2C(=O)C1)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H15F3N2O3/c1-2-26-17(25)11-7-15-13(16(24)8-11)9-14(22-23-15)10-4-3-5-12(6-10)18(19,20)21/h3-6,9,11H,2,7-8H2,1H3