[(2S)-3-(4-acetamidophenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(4-acetamidophenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(4-acetamidophenoxy)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-(4-acetamidophenoxy)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(4-acetamidophenoxy)-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-(4-acetamidophenoxy)-2-hydroxy-propyl]-methyl-ammonium Formula: C12H19N2O3+ MolecularWeight: 239.29086

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OCC(C[NH2+]C)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC[C@H](C[NH2+]C)O

InChI

InChI=1S/C12H18N2O3/c1-9(15)14-10-3-5-12(6-4-10)17-8-11(16)7-13-2/h3-6,11,13,16H,7-8H2,1-2H3,(H,14,15)/p+1/t11-/m0/s1