6,8-bis(fluoranyl)-1-(2-fluoranylethyl)-7-methoxy-4-oxidanylidene-N-phenethyl-quinoline-3-carboxamide

Systemtic Name: 6,8-bis(fluoranyl)-1-(2-fluoranylethyl)-7-methoxy-4-oxidanylidene-N-phenethyl-quinoline-3-carboxamide Openeye Name: 6,8-difluoro-1-(2-fluoroethyl)-7-methoxy-4-oxo-N-phenethyl-quinoline-3-carboxamide CAS Name: 6,8-difluoro-1-(2-fluoroethyl)-7-methoxy-4-oxo-N-phenethyl-3-quinolinecarboxamide IUPAC Name: 6,8-difluoro-1-(2-fluoroethyl)-7-methoxy-4-oxo-N-phenethylquinoline-3-carboxamide Traditional Name: 6,8-difluoro-1-(2-fluoroethyl)-4-keto-7-methoxy-N-phenethyl-quinoline-3-carboxamide Formula: C21H19F3N2O3 MolecularWeight: 404.38237

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1F)N(C=C(C2=O)C(=O)NCCC3=CC=CC=C3)CCF)F

Isomeric SMILES

COC1=C(C=C2C(=C1F)N(C=C(C2=O)C(=O)NCCC3=CC=CC=C3)CCF)F

InChI

InChI=1S/C21H19F3N2O3/c1-29-20-16(23)11-14-18(17(20)24)26(10-8-22)12-15(19(14)27)21(28)25-9-7-13-5-3-2-4-6-13/h2-6,11-12H,7-10H2,1H3,(H,25,28)