methyl (2S)-2-[[1-cyclopropyl-6,7-bis(fluoranyl)-8-methoxy-4-oxidanylidene-quinolin-3-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[[1-cyclopropyl-6,7-bis(fluoranyl)-8-methoxy-4-oxidanylidene-quinolin-3-yl]carbonylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[(1-cyclopropyl-6,7-difluoro-8-methoxy-4-oxo-quinoline-3-carbonyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(1-cyclopropyl-6,7-difluoro-8-methoxy-4-oxo-3-quinolinyl)-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1-cyclopropyl-6,7-difluoro-8-methoxy-4-oxoquinoline-3-carbonyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(1-cyclopropyl-6,7-difluoro-4-keto-8-methoxy-quinoline-3-carbonyl)amino]-3-methyl-butyric acid methyl ester Formula: C20H22F2N2O5 MolecularWeight: 408.395886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)OC)C3CC3

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)OC)C3CC3

InChI

InChI=1S/C20H22F2N2O5/c1-9(2)15(20(27)29-4)23-19(26)12-8-24(10-5-6-10)16-11(17(12)25)7-13(21)14(22)18(16)28-3/h7-10,15H,5-6H2,1-4H3,(H,23,26)/t15-/m0/s1