6-[(E)-2-[4-(4-fluorophenyl)-2-piperidin-1-yl-quinolin-3-yl]ethenyl]-4-oxidanyl-oxan-2-one

Systemtic Name: 6-[(E)-2-[4-(4-fluorophenyl)-2-piperidin-1-yl-quinolin-3-yl]ethenyl]-4-oxidanyl-oxan-2-one Openeye Name: 6-[(E)-2-[4-(4-fluorophenyl)-2-(1-piperidyl)-3-quinolyl]vinyl]-4-hydroxy-tetrahydropyran-2-one CAS Name: 6-[(E)-2-[4-(4-fluorophenyl)-2-(1-piperidinyl)-3-quinolinyl]ethenyl]-4-hydroxy-2-oxanone IUPAC Name: 6-[(E)-2-[4-(4-fluorophenyl)-2-piperidin-1-ylquinolin-3-yl]ethenyl]-4-hydroxyoxan-2-one Traditional Name: 6-[(E)-2-[4-(4-fluorophenyl)-2-piperidino-3-quinolyl]vinyl]-4-hydroxy-tetrahydropyran-2-one Formula: C27H27FN2O3 MolecularWeight: 446.513283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC3=CC=CC=C3C(=C2C=CC4CC(CC(=O)O4)O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(CC1)C2=NC3=CC=CC=C3C(=C2/C=C/C4CC(CC(=O)O4)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H27FN2O3/c28-19-10-8-18(9-11-19)26-22-6-2-3-7-24(22)29-27(30-14-4-1-5-15-30)23(26)13-12-21-16-20(31)17-25(32)33-21/h2-3,6-13,20-21,31H,1,4-5,14-17H2/b13-12+