[(2S)-1-[2-(2,5-dimethoxyphenyl)ethylamino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[2-(2,5-dimethoxyphenyl)ethylamino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[2-(2,5-dimethoxyphenyl)ethylamino]-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[2-(2,5-dimethoxyphenyl)ethylamino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[2-(2,5-dimethoxyphenyl)ethylamino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[2-(2,5-dimethoxyphenyl)ethylamino]-2-keto-1-methyl-ethyl]ammonium Formula: C13H21N2O3+ MolecularWeight: 253.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=C(C=CC(=C1)OC)OC)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NCCC1=C(C=CC(=C1)OC)OC)[NH3+]

InChI

InChI=1S/C13H20N2O3/c1-9(14)13(16)15-7-6-10-8-11(17-2)4-5-12(10)18-3/h4-5,8-9H,6-7,14H2,1-3H3,(H,15,16)/p+1/t9-/m0/s1