(E)-5,5,5-tris(fluoranyl)-1-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-4-oxidanyl-pent-3-en-2-one

Systemtic Name: (E)-5,5,5-tris(fluoranyl)-1-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-4-oxidanyl-pent-3-en-2-one Openeye Name: (E)-5,5,5-trifluoro-4-hydroxy-1-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)pent-3-en-2-one CAS Name: (E)-5,5,5-trifluoro-4-hydroxy-1-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-3-penten-2-one IUPAC Name: (E)-5,5,5-trifluoro-4-hydroxy-1-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)pent-3-en-2-one Traditional Name: (E)-5,5,5-trifluoro-4-hydroxy-1-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxol[4,5-g]isoquinolin-6-ium-5-yl)pent-3-en-2-one Formula: C18H21F3NO5+ MolecularWeight: 388.35825

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=CC3=C(C(=C2C1CC(=O)C=C(C(F)(F)F)O)OC)OCO3)C

Isomeric SMILES

C[N+]1(CCC2=CC3=C(C(=C2C1CC(=O)/C=C(\C(F)(F)F)/O)OC)OCO3)C

InChI

InChI=1S/C18H20F3NO5/c1-22(2)5-4-10-6-13-16(27-9-26-13)17(25-3)15(10)12(22)7-11(23)8-14(24)18(19,20)21/h6,8,12H,4-5,7,9H2,1-3H3/p+1