[(2S)-1,4-dioxan-2-yl]methyl-[(2-fluoranyl-4,5-dimethoxy-phenyl)methyl]azanium

Systemtic Name: [(2S)-1,4-dioxan-2-yl]methyl-[(2-fluoranyl-4,5-dimethoxy-phenyl)methyl]azanium Openeye Name: [(2S)-1,4-dioxan-2-yl]methyl-[(2-fluoro-4,5-dimethoxy-phenyl)methyl]ammonium CAS Name: [(2S)-1,4-dioxan-2-yl]methyl-[(2-fluoro-4,5-dimethoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-1,4-dioxan-2-yl]methyl-[(2-fluoro-4,5-dimethoxyphenyl)methyl]azanium Traditional Name: [(2S)-1,4-dioxan-2-yl]methyl-(2-fluoro-4,5-dimethoxy-benzyl)ammonium Formula: C14H21FNO4+ MolecularWeight: 286.319243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C[NH2+]CC2COCCO2)F)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C[NH2+]C[C@H]2COCCO2)F)OC

InChI

InChI=1S/C14H20FNO4/c1-17-13-5-10(12(15)6-14(13)18-2)7-16-8-11-9-19-3-4-20-11/h5-6,11,16H,3-4,7-9H2,1-2H3/p+1/t11-/m0/s1