4-[2,6-bis(chloranyl)-4-methyl-phenoxy]butyl-(2-hydroxyethyl)azanium

Systemtic Name: 4-[2,6-bis(chloranyl)-4-methyl-phenoxy]butyl-(2-hydroxyethyl)azanium Openeye Name: 4-(2,6-dichloro-4-methyl-phenoxy)butyl-(2-hydroxyethyl)ammonium CAS Name: 4-(2,6-dichloro-4-methylphenoxy)butyl-(2-hydroxyethyl)ammonium IUPAC Name: 4-(2,6-dichloro-4-methylphenoxy)butyl-(2-hydroxyethyl)azanium Traditional Name: 4-(2,6-dichloro-4-methyl-phenoxy)butyl-(2-hydroxyethyl)ammonium Formula: C13H20Cl2NO2+ MolecularWeight: 293.2094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)OCCCC[NH2+]CCO)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)OCCCC[NH2+]CCO)Cl

InChI

InChI=1S/C13H19Cl2NO2/c1-10-8-11(14)13(12(15)9-10)18-7-3-2-4-16-5-6-17/h8-9,16-17H,2-7H2,1H3/p+1