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

Systemtic Name: [(2S)-3-(4-methylphenoxy)-2-oxidanyl-propyl]-propyl-azanium Openeye Name: [(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]-propyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]-propylammonium IUPAC Name: [(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]-propylazanium Traditional Name: [(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]-propyl-ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC(COC1=CC=C(C=C1)C)O

Isomeric SMILES

CCC[NH2+]C[C@@H](COC1=CC=C(C=C1)C)O

InChI

InChI=1S/C13H21NO2/c1-3-8-14-9-12(15)10-16-13-6-4-11(2)5-7-13/h4-7,12,14-15H,3,8-10H2,1-2H3/p+1/t12-/m0/s1