2-[(2-bromanyl-5-ethoxy-4-propoxy-phenyl)methylazaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2-bromanyl-5-ethoxy-4-propoxy-phenyl)methylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[(2-bromo-5-ethoxy-4-propoxy-phenyl)methylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[(2-bromo-5-ethoxy-4-propoxyphenyl)methylammonio]ethyl-dimethylammonium IUPAC Name: 2-[(2-bromo-5-ethoxy-4-propoxyphenyl)methylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[(2-bromo-5-ethoxy-4-propoxy-benzyl)ammonio]ethyl-dimethyl-ammonium Formula: C16H29BrN2O2+2 MolecularWeight: 361.31766

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)Br)C[NH2+]CC[NH+](C)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)Br)C[NH2+]CC[NH+](C)C)OCC

InChI

InChI=1S/C16H27BrN2O2/c1-5-9-21-16-11-14(17)13(10-15(16)20-6-2)12-18-7-8-19(3)4/h10-11,18H,5-9,12H2,1-4H3/p+2