methyl 7-[cyano(phenyl)methyl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: methyl 7-[cyano(phenyl)methyl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: methyl 7-[cyano(phenyl)methyl]-1-cyclopropyl-6,8-difluoro-4-oxo-quinoline-3-carboxylate CAS Name: 7-[cyano(phenyl)methyl]-1-cyclopropyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 7-[cyano(phenyl)methyl]-1-cyclopropyl-6,8-difluoro-4-oxoquinoline-3-carboxylate Traditional Name: 7-[cyano(phenyl)methyl]-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid methyl ester Formula: C22H16F2N2O3 MolecularWeight: 394.370846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)C(C#N)C3=CC=CC=C3)F)C4CC4

Isomeric SMILES

COC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)C(C#N)C3=CC=CC=C3)F)C4CC4

InChI

InChI=1S/C22H16F2N2O3/c1-29-22(28)16-11-26(13-7-8-13)20-14(21(16)27)9-17(23)18(19(20)24)15(10-25)12-5-3-2-4-6-12/h2-6,9,11,13,15H,7-8H2,1H3