2-[(5-bromanyl-2-methoxy-phenyl)methylazaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[(5-bromo-2-methoxyphenyl)methylammonio]ethyl-dimethylammonium IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[(5-bromo-2-methoxy-benzyl)ammonio]ethyl-dimethyl-ammonium Formula: C12H21BrN2O+2 MolecularWeight: 289.21194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19BrN2O/c1-15(2)7-6-14-9-10-8-11(13)4-5-12(10)16-3/h4-5,8,14H,6-7,9H2,1-3H3/p+2