(3,4-dimethoxyphenyl)methyl-[[(2S)-1,4-dioxan-2-yl]methyl]azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-[[(2S)-1,4-dioxan-2-yl]methyl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-[[(2S)-1,4-dioxan-2-yl]methyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-[[(2S)-1,4-dioxan-2-yl]methyl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-[[(2S)-1,4-dioxan-2-yl]methyl]azanium Traditional Name: [(2S)-1,4-dioxan-2-yl]methyl-veratryl-ammonium Formula: C14H22NO4+ MolecularWeight: 268.32878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO4/c1-16-13-4-3-11(7-14(13)17-2)8-15-9-12-10-18-5-6-19-12/h3-4,7,12,15H,5-6,8-10H2,1-2H3/p+1/t12-/m0/s1