1-cyclopropyl-6-fluoranyl-7-[3-(hexylamino)propylamino]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[3-(hexylamino)propylamino]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[3-(hexylamino)propylamino]-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[3-(hexylamino)propylamino]-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[3-(hexylamino)propylamino]-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[3-(hexylamino)propylamino]-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C23H32FN3O4 MolecularWeight: 433.516283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCCCNC1=C(C=C2C(=C1OC)N(C=C(C2=O)C(=O)O)C3CC3)F

Isomeric SMILES

CCCCCCNCCCNC1=C(C=C2C(=C1OC)N(C=C(C2=O)C(=O)O)C3CC3)F

InChI

InChI=1S/C23H32FN3O4/c1-3-4-5-6-10-25-11-7-12-26-19-18(24)13-16-20(22(19)31-2)27(15-8-9-15)14-17(21(16)28)23(29)30/h13-15,25-26H,3-12H2,1-2H3,(H,29,30)