1-cyclopropyl-6-fluoranyl-7-[3-methyl-3-[methyl(2-oxidanylidenepropyl)amino]azetidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[3-methyl-3-[methyl(2-oxidanylidenepropyl)amino]azetidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[acetonyl(methyl)amino]-3-methyl-azetidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[3-methyl-3-[methyl(2-oxopropyl)amino]-1-azetidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[3-methyl-3-[methyl(2-oxopropyl)amino]azetidin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[acetonyl(methyl)amino]-3-methyl-azetidin-1-yl]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H24FN3O4 MolecularWeight: 401.431363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN(C)C1(CN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)C

Isomeric SMILES

CC(=O)CN(C)C1(CN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)C

InChI

InChI=1S/C21H24FN3O4/c1-12(26)8-23(3)21(2)10-24(11-21)18-7-17-14(6-16(18)22)19(27)15(20(28)29)9-25(17)13-4-5-13/h6-7,9,13H,4-5,8,10-11H2,1-3H3,(H,28,29)