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

Systemtic Name: 6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-(4-methylpiperazino)-1H-quinoline-3-carboxylic acid Formula: C15H16FN3O3 MolecularWeight: 305.304243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2)NC=C(C3=O)C(=O)O)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)NC=C(C3=O)C(=O)O)F

InChI

InChI=1S/C15H16FN3O3/c1-18-2-4-19(5-3-18)13-7-12-9(6-11(13)16)14(20)10(8-17-12)15(21)22/h6-8H,2-5H2,1H3,(H,17,20)(H,21,22)