3-[(3-bromanyl-4-phenylmethoxy-phenyl)methylazaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[(3-bromanyl-4-phenylmethoxy-phenyl)methylazaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[(4-benzyloxy-3-bromo-phenyl)methylammonio]propyl-dimethyl-ammonium CAS Name: 3-[(3-bromo-4-phenylmethoxyphenyl)methylammonio]propyl-dimethylammonium IUPAC Name: 3-[(3-bromo-4-phenylmethoxyphenyl)methylazaniumyl]propyl-dimethylazanium Traditional Name: 3-[(4-benzoxy-3-bromo-benzyl)ammonio]propyl-dimethyl-ammonium Formula: C19H27BrN2O+2 MolecularWeight: 379.33448

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CC=C2)Br

Isomeric SMILES

C[NH+](C)CCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C19H25BrN2O/c1-22(2)12-6-11-21-14-17-9-10-19(18(20)13-17)23-15-16-7-4-3-5-8-16/h3-5,7-10,13,21H,6,11-12,14-15H2,1-2H3/p+2