2-[3-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)propylazaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)propylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[3-(4-bromo-2-chloro-6-methyl-phenoxy)propylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[3-(4-bromo-2-chloro-6-methylphenoxy)propylammonio]ethyl-dimethylammonium IUPAC Name: 2-[3-(4-bromo-2-chloro-6-methylphenoxy)propylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[3-(4-bromo-2-chloro-6-methyl-phenoxy)propylammonio]ethyl-dimethyl-ammonium Formula: C14H24BrClN2O+2 MolecularWeight: 351.71016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22BrClN2O/c1-11-9-12(15)10-13(16)14(11)19-8-4-5-17-6-7-18(2)3/h9-10,17H,4-8H2,1-3H3/p+2