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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-(2-methoxyethyl)-3-phenyl-piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-(2-methoxyethyl)-3-phenyl-piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-(2-methoxyethyl)-3-phenyl-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-(2-methoxyethyl)-3-phenylpiperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-(2-methoxyethyl)-3-phenyl-piperazino]quinoline-3-carboxylic acid Formula: C26H28FN3O4 MolecularWeight: 465.516623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1CCN(CC1C2=CC=CC=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

Isomeric SMILES

COCCN1CCN(CC1C2=CC=CC=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

InChI

InChI=1S/C26H28FN3O4/c1-34-12-11-28-9-10-29(16-24(28)17-5-3-2-4-6-17)23-14-22-19(13-21(23)27)25(31)20(26(32)33)15-30(22)18-7-8-18/h2-6,13-15,18,24H,7-12,16H2,1H3,(H,32,33)