5-cyclopropyl-2-fluoranyl-1-[methyl-[6-(methylamino)hexyl]amino]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-cyclopropyl-2-fluoranyl-1-[methyl-[6-(methylamino)hexyl]amino]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-cyclopropyl-2-fluoro-1-[methyl-[6-(methylamino)hexyl]amino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-cyclopropyl-2-fluoro-1-[methyl-[6-(methylamino)hexyl]amino]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-cyclopropyl-2-fluoro-1-[methyl-[6-(methylamino)hexyl]amino]-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-cyclopropyl-2-fluoro-4-keto-1-[methyl-[6-(methylamino)hexyl]amino]quinoline-3-carboxylic acid Formula: C21H28FN3O3 MolecularWeight: 389.463723

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCCCN(C)N1C2=CC=CC(=C2C(=O)C(=C1F)C(=O)O)C3CC3

Isomeric SMILES

CNCCCCCCN(C)N1C2=CC=CC(=C2C(=O)C(=C1F)C(=O)O)C3CC3

InChI

InChI=1S/C21H28FN3O3/c1-23-12-5-3-4-6-13-24(2)25-16-9-7-8-15(14-10-11-14)17(16)19(26)18(20(25)22)21(27)28/h7-9,14,23H,3-6,10-13H2,1-2H3,(H,27,28)