7-[[3-chloranyl-2-(4-methoxyphenyl)-4-oxidanylidene-azetidin-1-yl]amino]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[[3-chloranyl-2-(4-methoxyphenyl)-4-oxidanylidene-azetidin-1-yl]amino]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[[3-chloro-2-(4-methoxyphenyl)-4-oxo-azetidin-1-yl]amino]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[[3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl]amino]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[[3-chloro-2-(4-methoxyphenyl)-4-oxoazetidin-1-yl]amino]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[[3-chloro-2-keto-4-(4-methoxyphenyl)azetidin-1-yl]amino]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C22H19ClFN3O5 MolecularWeight: 459.854763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)NN3C(C(C3=O)Cl)C4=CC=C(C=C4)OC)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)NN3C(C(C3=O)Cl)C4=CC=C(C=C4)OC)F)C(=O)O

InChI

InChI=1S/C22H19ClFN3O5/c1-3-26-10-14(22(30)31)20(28)13-8-15(24)16(9-17(13)26)25-27-19(18(23)21(27)29)11-4-6-12(32-2)7-5-11/h4-10,18-19,25H,3H2,1-2H3,(H,30,31)