[(2S)-1-(2,3,5-trimethylphenoxy)propan-2-yl]azanium

Systemtic Name: [(2S)-1-(2,3,5-trimethylphenoxy)propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-(2,3,5-trimethylphenoxy)ethyl]ammonium CAS Name: [(2S)-1-(2,3,5-trimethylphenoxy)propan-2-yl]ammonium IUPAC Name: [(2S)-1-(2,3,5-trimethylphenoxy)propan-2-yl]azanium Traditional Name: [(1S)-1-methyl-2-(2,3,5-trimethylphenoxy)ethyl]ammonium Formula: C12H20NO+ MolecularWeight: 194.2933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC(C)[NH3+])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC[C@H](C)[NH3+])C)C

InChI

InChI=1S/C12H19NO/c1-8-5-9(2)11(4)12(6-8)14-7-10(3)13/h5-6,10H,7,13H2,1-4H3/p+1/t10-/m0/s1