1-ethyl-6-fluoranyl-4-oxidanylidene-7-[4-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]piperazin-1-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-4-oxidanylidene-7-[4-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]piperazin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-4-oxo-7-[4-[2-oxo-2-(2-oxochromen-3-yl)ethyl]piperazin-1-yl]quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-4-oxo-7-[4-[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]-1-piperazinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-4-oxo-7-[4-[2-oxo-2-(2-oxochromen-3-yl)ethyl]piperazin-1-yl]quinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-[4-[2-keto-2-(2-ketochromen-3-yl)ethyl]piperazino]quinoline-3-carboxylic acid Formula: C27H24FN3O6 MolecularWeight: 505.494363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)CC(=O)C4=CC5=CC=CC=C5OC4=O)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)CC(=O)C4=CC5=CC=CC=C5OC4=O)F)C(=O)O

InChI

InChI=1S/C27H24FN3O6/c1-2-30-14-19(26(34)35)25(33)17-12-20(28)22(13-21(17)30)31-9-7-29(8-10-31)15-23(32)18-11-16-5-3-4-6-24(16)37-27(18)36/h3-6,11-14H,2,7-10,15H2,1H3,(H,34,35)