[(2S)-2-oxidanyl-3-(2,3,6-trimethylphenoxy)propyl]-propyl-azanium

Systemtic Name: [(2S)-2-oxidanyl-3-(2,3,6-trimethylphenoxy)propyl]-propyl-azanium Openeye Name: [(2S)-2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-propyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-propylammonium IUPAC Name: [(2S)-2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-propylazanium Traditional Name: [(2S)-2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-propyl-ammonium Formula: C15H26NO2+ MolecularWeight: 252.37244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC(COC1=C(C=CC(=C1C)C)C)O

Isomeric SMILES

CCC[NH2+]C[C@@H](COC1=C(C=CC(=C1C)C)C)O

InChI

InChI=1S/C15H25NO2/c1-5-8-16-9-14(17)10-18-15-12(3)7-6-11(2)13(15)4/h6-7,14,16-17H,5,8-10H2,1-4H3/p+1/t14-/m0/s1