7-[(4aS,7aS)-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazin-6-yl]-8-[bis(fluoranyl)methoxy]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(4aS,7aS)-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazin-6-yl]-8-[bis(fluoranyl)methoxy]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(4aS,7aS)-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazin-6-yl]-1-cyclopropyl-8-(difluoromethoxy)-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(4aS,7aS)-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazin-6-yl]-1-cyclopropyl-8-(difluoromethoxy)-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(4aS,7aS)-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazin-6-yl]-1-cyclopropyl-8-(difluoromethoxy)-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(4aS,7aS)-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazin-6-yl]-1-cyclopropyl-8-(difluoromethoxy)-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H20F3N3O5 MolecularWeight: 439.38511

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)OC(F)F)N4CC5C(C4)OCCN5)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)OC(F)F)N4C[C@H]5[C@H](C4)OCCN5)F)C(=O)O

InChI

InChI=1S/C20H20F3N3O5/c21-12-5-10-15(26(9-1-2-9)6-11(17(10)27)19(28)29)18(31-20(22)23)16(12)25-7-13-14(8-25)30-4-3-24-13/h5-6,9,13-14,20,24H,1-4,7-8H2,(H,28,29)/t13-,14-/m0/s1