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

Systemtic Name: 6-fluoranyl-2-methyl-1-(3-methylbut-2-enyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-2-methyl-1-(3-methylbut-2-enyl)-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 6-fluoro-2-methyl-1-(3-methylbut-2-enyl)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-2-methyl-1-(3-methylbut-2-enyl)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-2-methyl-1-(3-methylbut-2-enyl)-7-piperazino-quinoline-3-carboxylic acid Formula: C20H24FN3O3 MolecularWeight: 373.421263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC(=C(C=C2N1CC=C(C)C)N3CCNCC3)F)C(=O)O

Isomeric SMILES

CC1=C(C(=O)C2=CC(=C(C=C2N1CC=C(C)C)N3CCNCC3)F)C(=O)O

InChI

InChI=1S/C20H24FN3O3/c1-12(2)4-7-24-13(3)18(20(26)27)19(25)14-10-15(21)17(11-16(14)24)23-8-5-22-6-9-23/h4,10-11,22H,5-9H2,1-3H3,(H,26,27)