(3-bromanyl-4-phenylmethoxy-phenyl)methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: (3-bromanyl-4-phenylmethoxy-phenyl)methyl-(pyridin-3-ylmethyl)azanium Openeye Name: (4-benzyloxy-3-bromo-phenyl)methyl-(3-pyridylmethyl)ammonium CAS Name: (3-bromo-4-phenylmethoxyphenyl)methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (3-bromo-4-phenylmethoxyphenyl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: (4-benzoxy-3-bromo-benzyl)-(3-pyridylmethyl)ammonium Formula: C20H20BrN2O+ MolecularWeight: 384.2896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C[NH2+]CC3=CN=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C[NH2+]CC3=CN=CC=C3)Br

InChI

InChI=1S/C20H19BrN2O/c21-19-11-17(12-23-14-18-7-4-10-22-13-18)8-9-20(19)24-15-16-5-2-1-3-6-16/h1-11,13,23H,12,14-15H2/p+1