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

Systemtic Name: ethyl 1-[2,4-bis(fluoranyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-7-fluoranyl-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-[5-(tert-butoxycarbonylamino)-2,4-difluoro-phenyl]-7-fluoro-8-methyl-6-nitro-4-oxo-quinoline-3-carboxylate CAS Name: 1-[2,4-difluoro-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-7-fluoro-8-methyl-6-nitro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2,4-difluoro-5-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-7-fluoro-8-methyl-6-nitro-4-oxoquinoline-3-carboxylate Traditional Name: 1-[5-(tert-butoxycarbonylamino)-2,4-difluoro-phenyl]-7-fluoro-4-keto-8-methyl-6-nitro-quinoline-3-carboxylic acid ethyl ester Formula: C24H22F3N3O7 MolecularWeight: 521.44259

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C24H22F3N3O7/c1-6-36-22(32)13-10-29(20-11(2)19(27)18(30(34)35)7-12(20)21(13)31)17-9-16(14(25)8-15(17)26)28-23(33)37-24(3,4)5/h7-10H,6H2,1-5H3,(H,28,33)