2-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylazaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[(4-allyloxy-3-bromo-5-methoxy-phenyl)methylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylammonio]ethyl-dimethylammonium IUPAC Name: 2-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[(4-allyloxy-3-bromo-5-methoxy-benzyl)ammonio]ethyl-dimethyl-ammonium Formula: C15H25BrN2O2+2 MolecularWeight: 345.2752

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH2+]CC1=CC(=C(C(=C1)Br)OCC=C)OC

Isomeric SMILES

C[NH+](C)CC[NH2+]CC1=CC(=C(C(=C1)Br)OCC=C)OC

InChI

InChI=1S/C15H23BrN2O2/c1-5-8-20-15-13(16)9-12(10-14(15)19-4)11-17-6-7-18(2)3/h5,9-10,17H,1,6-8,11H2,2-4H3/p+2