ethyl 1-[6-(tert-butylamino)-3,5-bis(fluoranyl)pyridin-2-yl]-6-fluoranyl-8-methyl-7-nitro-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-[6-(tert-butylamino)-3,5-bis(fluoranyl)pyridin-2-yl]-6-fluoranyl-8-methyl-7-nitro-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-[6-(tert-butylamino)-3,5-difluoro-2-pyridyl]-6-fluoro-8-methyl-7-nitro-4-oxo-quinoline-3-carboxylate CAS Name: 1-[6-(tert-butylamino)-3,5-difluoro-2-pyridinyl]-6-fluoro-8-methyl-7-nitro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-(tert-butylamino)-3,5-difluoropyridin-2-yl]-6-fluoro-8-methyl-7-nitro-4-oxoquinoline-3-carboxylate Traditional Name: 1-[6-(tert-butylamino)-3,5-difluoro-2-pyridyl]-6-fluoro-4-keto-8-methyl-7-nitro-quinoline-3-carboxylic acid ethyl ester Formula: C22H21F3N4O5 MolecularWeight: 478.42115

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)[N+](=O)[O-])C)C3=NC(=C(C=C3F)F)NC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)[N+](=O)[O-])C)C3=NC(=C(C=C3F)F)NC(C)(C)C

InChI

InChI=1S/C22H21F3N4O5/c1-6-34-21(31)12-9-28(20-15(25)8-14(24)19(26-20)27-22(3,4)5)16-10(2)17(29(32)33)13(23)7-11(16)18(12)30/h7-9H,6H2,1-5H3,(H,26,27)