1-cyclopropyl-6-fluoranyl-7-[4-[3-(2-fluorophenyl)propanoyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-[3-(2-fluorophenyl)propanoyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-[3-(2-fluorophenyl)propanoyl]piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-[3-(2-fluorophenyl)-1-oxopropyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-[3-(2-fluorophenyl)propanoyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[4-[3-(2-fluorophenyl)propanoyl]piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C26H25F2N3O4 MolecularWeight: 481.491206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)CCC5=CC=CC=C5F)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)CCC5=CC=CC=C5F)F)C(=O)O

InChI

InChI=1S/C26H25F2N3O4/c27-20-4-2-1-3-16(20)5-8-24(32)30-11-9-29(10-12-30)23-14-22-18(13-21(23)28)25(33)19(26(34)35)15-31(22)17-6-7-17/h1-4,13-15,17H,5-12H2,(H,34,35)