ethyl 1-cyclopropyl-7-(dicyanomethyl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-7-(dicyanomethyl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-7-(dicyanomethyl)-6,8-difluoro-4-oxo-quinoline-3-carboxylate CAS Name: 1-cyclopropyl-7-(dicyanomethyl)-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-7-(dicyanomethyl)-6,8-difluoro-4-oxoquinoline-3-carboxylate Traditional Name: 1-cyclopropyl-7-(dicyanomethyl)-6,8-difluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C18H13F2N3O3 MolecularWeight: 357.310926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)C(C#N)C#N)F)C3CC3

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)C(C#N)C#N)F)C3CC3

InChI

InChI=1S/C18H13F2N3O3/c1-2-26-18(25)12-8-23(10-3-4-10)16-11(17(12)24)5-13(19)14(15(16)20)9(6-21)7-22/h5,8-10H,2-4H2,1H3