7-[(3S)-3-azanyl-2,2-dimethyl-azetidin-1-yl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(3S)-3-azanyl-2,2-dimethyl-azetidin-1-yl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(3S)-3-amino-2,2-dimethyl-azetidin-1-yl]-1-cyclopropyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(3S)-3-amino-2,2-dimethyl-1-azetidinyl]-1-cyclopropyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(3S)-3-amino-2,2-dimethylazetidin-1-yl]-1-cyclopropyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(3S)-3-amino-2,2-dimethyl-azetidin-1-yl]-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H19F2N3O3 MolecularWeight: 363.358566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CN1C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F)N)C

Isomeric SMILES

CC1([C@H](CN1C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F)N)C

InChI

InChI=1S/C18H19F2N3O3/c1-18(2)12(21)7-23(18)15-11(19)5-9-14(13(15)20)22(8-3-4-8)6-10(16(9)24)17(25)26/h5-6,8,12H,3-4,7,21H2,1-2H3,(H,25,26)/t12-/m0/s1