2-[3-(2-azanylpropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 2-[3-(2-azanylpropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 2-[3-(1-amino-1-methyl-ethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 2-[3-(2-aminopropan-2-yl)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 2-[3-(2-aminopropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 2-[3-(1-amino-1-methyl-ethyl)pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C21H26FN3O4 MolecularWeight: 403.447243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCN(C1)C2=C(C(=O)C3=CC(=CC(=C3N2C4CC4)OC)F)C(=O)O)N

Isomeric SMILES

CC(C)(C1CCN(C1)C2=C(C(=O)C3=CC(=CC(=C3N2C4CC4)OC)F)C(=O)O)N

InChI

InChI=1S/C21H26FN3O4/c1-21(2,23)11-6-7-24(10-11)19-16(20(27)28)18(26)14-8-12(22)9-15(29-3)17(14)25(19)13-4-5-13/h8-9,11,13H,4-7,10,23H2,1-3H3,(H,27,28)