6-[2-[4-(4-fluorophenyl)-2-(4-methylpiperazin-1-yl)quinolin-3-yl]ethyl]-4-oxidanyl-oxan-2-one

Systemtic Name: 6-[2-[4-(4-fluorophenyl)-2-(4-methylpiperazin-1-yl)quinolin-3-yl]ethyl]-4-oxidanyl-oxan-2-one Openeye Name: 6-[2-[4-(4-fluorophenyl)-2-(4-methylpiperazin-1-yl)-3-quinolyl]ethyl]-4-hydroxy-tetrahydropyran-2-one CAS Name: 6-[2-[4-(4-fluorophenyl)-2-(4-methyl-1-piperazinyl)-3-quinolinyl]ethyl]-4-hydroxy-2-oxanone IUPAC Name: 6-[2-[4-(4-fluorophenyl)-2-(4-methylpiperazin-1-yl)quinolin-3-yl]ethyl]-4-hydroxyoxan-2-one Traditional Name: 6-[2-[4-(4-fluorophenyl)-2-(4-methylpiperazino)-3-quinolyl]ethyl]-4-hydroxy-tetrahydropyran-2-one Formula: C27H30FN3O3 MolecularWeight: 463.543803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3C(=C2CCC4CC(CC(=O)O4)O)C5=CC=C(C=C5)F

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3C(=C2CCC4CC(CC(=O)O4)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H30FN3O3/c1-30-12-14-31(15-13-30)27-23(11-10-21-16-20(32)17-25(33)34-21)26(18-6-8-19(28)9-7-18)22-4-2-3-5-24(22)29-27/h2-9,20-21,32H,10-17H2,1H3