(5-bromanyl-2-phenylmethoxy-phenyl)methyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (5-bromanyl-2-phenylmethoxy-phenyl)methyl-(pyridin-4-ylmethyl)azanium Openeye Name: (2-benzyloxy-5-bromo-phenyl)methyl-(4-pyridylmethyl)ammonium CAS Name: (5-bromo-2-phenylmethoxyphenyl)methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (5-bromo-2-phenylmethoxyphenyl)methyl-(pyridin-4-ylmethyl)azanium Traditional Name: (2-benzoxy-5-bromo-benzyl)-(4-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)Br)C[NH2+]CC3=CC=NC=C3

Isomeric SMILES

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

InChI

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