ethyl 1-[2,4-bis(fluoranyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-8-chloranyl-6,7-bis(fluoranyl)-5-methyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-[2,4-bis(fluoranyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-8-chloranyl-6,7-bis(fluoranyl)-5-methyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-[5-(tert-butoxycarbonylamino)-2,4-difluoro-phenyl]-8-chloro-6,7-difluoro-5-methyl-4-oxo-quinoline-3-carboxylate CAS Name: 8-chloro-1-[2,4-difluoro-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-6,7-difluoro-5-methyl-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 8-chloro-1-[2,4-difluoro-5-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-6,7-difluoro-5-methyl-4-oxoquinoline-3-carboxylate Traditional Name: 1-[5-(tert-butoxycarbonylamino)-2,4-difluoro-phenyl]-8-chloro-6,7-difluoro-4-keto-5-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C24H21ClF4N2O5 MolecularWeight: 528.880553

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C(=C2C1=O)C)F)F)Cl)C3=CC(=C(C=C3F)F)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C(=C2C1=O)C)F)F)Cl)C3=CC(=C(C=C3F)F)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H21ClF4N2O5/c1-6-35-22(33)11-9-31(20-16(21(11)32)10(2)18(28)19(29)17(20)25)15-8-14(12(26)7-13(15)27)30-23(34)36-24(3,4)5/h7-9H,6H2,1-5H3,(H,30,34)