(3E,6R,8S,9aS)-6-(4-fluorophenyl)-3-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-8-methyl-8-oxidanyl-1,2,6,7,9,9a-hexahydroquinolizin-4-one

Systemtic Name: (3E,6R,8S,9aS)-6-(4-fluorophenyl)-3-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-8-methyl-8-oxidanyl-1,2,6,7,9,9a-hexahydroquinolizin-4-one Openeye Name: (3E,6R,8S,9aS)-6-(4-fluorophenyl)-8-hydroxy-3-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylene]-8-methyl-1,2,6,7,9,9a-hexahydroquinolizin-4-one CAS Name: (3E,6R,8S,9aS)-6-(4-fluorophenyl)-8-hydroxy-3-[[3-methoxy-4-(4-methyl-1-imidazolyl)phenyl]methylidene]-8-methyl-1,2,6,7,9,9a-hexahydroquinolizin-4-one IUPAC Name: (3E,6R,8S,9aS)-6-(4-fluorophenyl)-8-hydroxy-3-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-8-methyl-1,2,6,7,9,9a-hexahydroquinolizin-4-one Traditional Name: (3E,6R,8S,9aS)-6-(4-fluorophenyl)-8-hydroxy-3-[3-methoxy-4-(4-methylimidazol-1-yl)benzylidene]-8-methyl-quinolizidin-4-one Formula: C28H30FN3O3 MolecularWeight: 475.554503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C2=C(C=C(C=C2)C=C3CCC4CC(CC(N4C3=O)C5=CC=C(C=C5)F)(C)O)OC

Isomeric SMILES

CC1=CN(C=N1)C2=C(C=C(C=C2)/C=C/3\CC[C@H]4C[C@](C[C@@H](N4C3=O)C5=CC=C(C=C5)F)(C)O)OC

InChI

InChI=1S/C28H30FN3O3/c1-18-16-31(17-30-18)24-11-4-19(13-26(24)35-3)12-21-7-10-23-14-28(2,34)15-25(32(23)27(21)33)20-5-8-22(29)9-6-20/h4-6,8-9,11-13,16-17,23,25,34H,7,10,14-15H2,1-3H3/b21-12+/t23-,25+,28-/m0/s1