[(2S)-3-[2,3-bis(chloranyl)phenoxy]-2-oxidanyl-propyl]-propyl-azanium

Systemtic Name: [(2S)-3-[2,3-bis(chloranyl)phenoxy]-2-oxidanyl-propyl]-propyl-azanium Openeye Name: [(2S)-3-(2,3-dichlorophenoxy)-2-hydroxy-propyl]-propyl-ammonium CAS Name: [(2S)-3-(2,3-dichlorophenoxy)-2-hydroxypropyl]-propylammonium IUPAC Name: [(2S)-3-(2,3-dichlorophenoxy)-2-hydroxypropyl]-propylazanium Traditional Name: [(2S)-3-(2,3-dichlorophenoxy)-2-hydroxy-propyl]-propyl-ammonium Formula: C12H18Cl2NO2+ MolecularWeight: 279.18282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17Cl2NO2/c1-2-6-15-7-9(16)8-17-11-5-3-4-10(13)12(11)14/h3-5,9,15-16H,2,6-8H2,1H3/p+1/t9-/m0/s1