(3-bromanyl-4-phenylmethoxy-phenyl)methyl-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: (3-bromanyl-4-phenylmethoxy-phenyl)methyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: (4-benzyloxy-3-bromo-phenyl)methyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: (3-bromo-4-phenylmethoxyphenyl)methyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: (3-bromo-4-phenylmethoxyphenyl)methyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: (4-benzoxy-3-bromo-benzyl)-p-anisyl-ammonium Formula: C22H23BrNO2+ MolecularWeight: 413.32752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH2+]CC2=CC(=C(C=C2)OCC3=CC=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)C[NH2+]CC2=CC(=C(C=C2)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C22H22BrNO2/c1-25-20-10-7-17(8-11-20)14-24-15-19-9-12-22(21(23)13-19)26-16-18-5-3-2-4-6-18/h2-13,24H,14-16H2,1H3/p+1