2-[2-(4-tert-butyl-2-chloranyl-phenoxy)ethylazaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-(4-tert-butyl-2-chloranyl-phenoxy)ethylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[2-(4-tert-butyl-2-chloro-phenoxy)ethylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[2-(4-tert-butyl-2-chlorophenoxy)ethylammonio]ethyl-dimethylammonium IUPAC Name: 2-[2-(4-tert-butyl-2-chlorophenoxy)ethylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[2-(4-tert-butyl-2-chloro-phenoxy)ethylammonio]ethyl-dimethyl-ammonium Formula: C16H29ClN2O+2 MolecularWeight: 300.86726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC[NH2+]CC[NH+](C)C)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC[NH2+]CC[NH+](C)C)Cl

InChI

InChI=1S/C16H27ClN2O/c1-16(2,3)13-6-7-15(14(17)12-13)20-11-9-18-8-10-19(4)5/h6-7,12,18H,8-11H2,1-5H3/p+2