6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-(propylamino)quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-(propylamino)quinoline-3-carboxylic acid Openeye Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-(propylamino)quinoline-3-carboxylic acid CAS Name: 6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-1-(propylamino)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-(propylamino)quinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-(4-methylpiperazino)-1-(propylamino)quinoline-3-carboxylic acid Formula: C18H23FN4O3 MolecularWeight: 362.398623

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Descriptors Computed from Structure

Canonical SMILES:

CCCNN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)O

Isomeric SMILES

CCCNN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)O

InChI

InChI=1S/C18H23FN4O3/c1-3-4-20-23-11-13(18(25)26)17(24)12-9-14(19)16(10-15(12)23)22-7-5-21(2)6-8-22/h9-11,20H,3-8H2,1-2H3,(H,25,26)