(E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-5-oxidanyl-hept-6-en-3-one

Systemtic Name: (E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-5-oxidanyl-hept-6-en-3-one Openeye Name: (E)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl]-5-hydroxy-hept-6-en-3-one CAS Name: (E)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-5-hydroxy-6-hepten-3-one IUPAC Name: (E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-5-hydroxyhept-6-en-3-one Traditional Name: (E)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl]-5-hydroxy-hept-6-en-3-one Formula: C25H24FNO2 MolecularWeight: 389.461963

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(C=CC1=C(C2=CC=CC=C2N=C1C3CC3)C4=CC=C(C=C4)F)O

Isomeric SMILES

CCC(=O)CC(/C=C/C1=C(C2=CC=CC=C2N=C1C3CC3)C4=CC=C(C=C4)F)O

InChI

InChI=1S/C25H24FNO2/c1-2-19(28)15-20(29)13-14-22-24(16-9-11-18(26)12-10-16)21-5-3-4-6-23(21)27-25(22)17-7-8-17/h3-6,9-14,17,20,29H,2,7-8,15H2,1H3/b14-13+