[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl]-[(3,4-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: [(2R)-1-amino-1-oxopropan-2-yl]-[(3,4-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl]-[(3,4-dimethoxyphenyl)methyl]-methylazanium Traditional Name: [(1R)-2-amino-2-keto-1-methyl-ethyl]-methyl-veratryl-ammonium Formula: C13H21N2O3+ MolecularWeight: 253.31744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)[NH+](C)CC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

C[C@H](C(=O)N)[NH+](C)CC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C13H20N2O3/c1-9(13(14)16)15(2)8-10-5-6-11(17-3)12(7-10)18-4/h5-7,9H,8H2,1-4H3,(H2,14,16)/p+1/t9-/m1/s1