[(1R,2S)-1-(3,4-dimethoxyphenyl)-1-oxidanyl-butan-2-yl]azanium

Systemtic Name: [(1R,2S)-1-(3,4-dimethoxyphenyl)-1-oxidanyl-butan-2-yl]azanium Openeye Name: [(1S)-1-[(R)-(3,4-dimethoxyphenyl)-hydroxy-methyl]propyl]ammonium CAS Name: [(1R,2S)-1-(3,4-dimethoxyphenyl)-1-hydroxybutan-2-yl]ammonium IUPAC Name: [(1R,2S)-1-(3,4-dimethoxyphenyl)-1-hydroxybutan-2-yl]azanium Traditional Name: [(1S)-1-[(R)-(3,4-dimethoxyphenyl)-hydroxy-methyl]propyl]ammonium Formula: C12H20NO3+ MolecularWeight: 226.2921

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC(=C(C=C1)OC)OC)O)[NH3+]

Isomeric SMILES

CC[C@@H]([C@@H](C1=CC(=C(C=C1)OC)OC)O)[NH3+]

InChI

InChI=1S/C12H19NO3/c1-4-9(13)12(14)8-5-6-10(15-2)11(7-8)16-3/h5-7,9,12,14H,4,13H2,1-3H3/p+1/t9-,12+/m0/s1