3-[2,4-bis(chloranyl)-6-methyl-phenoxy]propyl-tert-butyl-azanium

Systemtic Name: 3-[2,4-bis(chloranyl)-6-methyl-phenoxy]propyl-tert-butyl-azanium Openeye Name: tert-butyl-[3-(2,4-dichloro-6-methyl-phenoxy)propyl]ammonium CAS Name: tert-butyl-[3-(2,4-dichloro-6-methylphenoxy)propyl]ammonium IUPAC Name: tert-butyl-[3-(2,4-dichloro-6-methylphenoxy)propyl]azanium Traditional Name: tert-butyl-[3-(2,4-dichloro-6-methyl-phenoxy)propyl]ammonium Formula: C14H22Cl2NO+ MolecularWeight: 291.23658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCC[NH2+]C(C)(C)C)Cl)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCCC[NH2+]C(C)(C)C)Cl)Cl

InChI

InChI=1S/C14H21Cl2NO/c1-10-8-11(15)9-12(16)13(10)18-7-5-6-17-14(2,3)4/h8-9,17H,5-7H2,1-4H3/p+1