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

Systemtic Name: 3-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]ethenyl]-4-oxidanyl-oxan-2-one Openeye Name: 3-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl]vinyl]-4-hydroxy-tetrahydropyran-2-one CAS Name: 3-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]ethenyl]-4-hydroxy-2-oxanone IUPAC Name: 3-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]ethenyl]-4-hydroxyoxan-2-one Traditional Name: 3-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl]vinyl]-4-hydroxy-tetrahydropyran-2-one Formula: C25H22FNO3 MolecularWeight: 403.445483

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=C2C=CC4C(CCOC4=O)O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=C2/C=C/C4C(CCOC4=O)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H22FNO3/c26-17-9-7-15(8-10-17)23-18-3-1-2-4-21(18)27-24(16-5-6-16)20(23)12-11-19-22(28)13-14-30-25(19)29/h1-4,7-12,16,19,22,28H,5-6,13-14H2/b12-11+