3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl-butyl-azanium

Systemtic Name: 3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl-butyl-azanium Openeye Name: 3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl-butyl-ammonium CAS Name: 3-(2-bromo-6-chloro-4-methylphenoxy)propyl-butylammonium IUPAC Name: 3-(2-bromo-6-chloro-4-methylphenoxy)propyl-butylazanium Traditional Name: 3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl-butyl-ammonium Formula: C14H22BrClNO+ MolecularWeight: 335.68758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CCCOC1=C(C=C(C=C1Br)C)Cl

Isomeric SMILES

CCCC[NH2+]CCCOC1=C(C=C(C=C1Br)C)Cl

InChI

InChI=1S/C14H21BrClNO/c1-3-4-6-17-7-5-8-18-14-12(15)9-11(2)10-13(14)16/h9-10,17H,3-8H2,1-2H3/p+1