7-[2-(ethylaminomethyl)-3-methyl-azetidin-1-yl]-6-fluoranyl-4-oxidanylidene-1-[2-[2,2,2-tris(fluoranyl)ethanoylamino]cyclopropyl]quinoline-3-carboxylic acid

Systemtic Name: 7-[2-(ethylaminomethyl)-3-methyl-azetidin-1-yl]-6-fluoranyl-4-oxidanylidene-1-[2-[2,2,2-tris(fluoranyl)ethanoylamino]cyclopropyl]quinoline-3-carboxylic acid Openeye Name: 7-[2-(ethylaminomethyl)-3-methyl-azetidin-1-yl]-6-fluoro-4-oxo-1-[2-[(2,2,2-trifluoroacetyl)amino]cyclopropyl]quinoline-3-carboxylic acid CAS Name: 7-[2-(ethylaminomethyl)-3-methyl-1-azetidinyl]-6-fluoro-4-oxo-1-[2-[(2,2,2-trifluoro-1-oxoethyl)amino]cyclopropyl]-3-quinolinecarboxylic acid IUPAC Name: 7-[2-(ethylaminomethyl)-3-methylazetidin-1-yl]-6-fluoro-4-oxo-1-[2-[(2,2,2-trifluoroacetyl)amino]cyclopropyl]quinoline-3-carboxylic acid Traditional Name: 7-[2-(ethylaminomethyl)-3-methyl-azetidin-1-yl]-6-fluoro-4-keto-1-[2-[(2,2,2-trifluoroacetyl)amino]cyclopropyl]quinoline-3-carboxylic acid Formula: C22H24F4N4O4 MolecularWeight: 484.443973

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1C(CN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4NC(=O)C(F)(F)F)F)C

Isomeric SMILES

CCNCC1C(CN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4NC(=O)C(F)(F)F)F)C

InChI

InChI=1S/C22H24F4N4O4/c1-3-27-7-18-10(2)8-29(18)16-6-15-11(4-13(16)23)19(31)12(20(32)33)9-30(15)17-5-14(17)28-21(34)22(24,25)26/h4,6,9-10,14,17-18,27H,3,5,7-8H2,1-2H3,(H,28,34)(H,32,33)