(5-bromanyl-2-phenylmethoxy-phenyl)methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: (5-bromanyl-2-phenylmethoxy-phenyl)methyl-(pyridin-3-ylmethyl)azanium Openeye Name: (2-benzyloxy-5-bromo-phenyl)methyl-(3-pyridylmethyl)ammonium CAS Name: (5-bromo-2-phenylmethoxyphenyl)methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (5-bromo-2-phenylmethoxyphenyl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: (2-benzoxy-5-bromo-benzyl)-(3-pyridylmethyl)ammonium Formula: C20H20BrN2O+ MolecularWeight: 384.2896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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