(5-bromanyl-2-methoxy-phenyl)methyl-bis[3-(dimethylazaniumyl)propyl]azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-bis[3-(dimethylazaniumyl)propyl]azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-bis[3-(dimethylammonio)propyl]ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-bis[3-(dimethylammonio)propyl]ammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-bis[3-(dimethylazaniumyl)propyl]azanium Traditional Name: (5-bromo-2-methoxy-benzyl)-bis[3-(dimethylammonio)propyl]ammonium Formula: C18H35BrN3O+3 MolecularWeight: 389.394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H32BrN3O/c1-20(2)10-6-12-22(13-7-11-21(3)4)15-16-14-17(19)8-9-18(16)23-5/h8-9,14H,6-7,10-13,15H2,1-5H3/p+3