6-fluoranyl-2-methyl-1-(3-methylbut-2-enyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-2-methyl-1-(3-methylbut-2-enyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-2-methyl-1-(3-methylbut-2-enyl)-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-2-methyl-1-(3-methylbut-2-enyl)-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-2-methyl-1-(3-methylbut-2-enyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-2-methyl-1-(3-methylbut-2-enyl)-7-(4-methylpiperazino)quinoline-3-carboxylic acid Formula: C21H26FN3O3 MolecularWeight: 387.447843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC(=C(C=C2N1CC=C(C)C)N3CCN(CC3)C)F)C(=O)O

Isomeric SMILES

CC1=C(C(=O)C2=CC(=C(C=C2N1CC=C(C)C)N3CCN(CC3)C)F)C(=O)O

InChI

InChI=1S/C21H26FN3O3/c1-13(2)5-6-25-14(3)19(21(27)28)20(26)15-11-16(22)18(12-17(15)25)24-9-7-23(4)8-10-24/h5,11-12H,6-10H2,1-4H3,(H,27,28)