(2R)-1,1,1-tris(fluoranyl)-3-[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]propan-2-ol

Systemtic Name: (2R)-1,1,1-tris(fluoranyl)-3-[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]propan-2-ol Openeye Name: (2R)-1,1,1-trifluoro-3-[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]propan-2-ol CAS Name: (2R)-1,1,1-trifluoro-3-[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]-2-propanol IUPAC Name: (2R)-1,1,1-trifluoro-3-[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]propan-2-ol Traditional Name: (2R)-1,1,1-trifluoro-3-[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxol[4,5-g]isoquinolin-6-ium-5-yl]propan-2-ol Formula: C15H19F3NO4+ MolecularWeight: 334.31087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[NH+]1CCC2=CC3=C(C(=C2[C@@H]1C[C@H](C(F)(F)F)O)OC)OCO3

InChI

InChI=1S/C15H18F3NO4/c1-19-4-3-8-5-10-13(23-7-22-10)14(21-2)12(8)9(19)6-11(20)15(16,17)18/h5,9,11,20H,3-4,6-7H2,1-2H3/p+1/t9-,11+/m0/s1