[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl-(phenylmethyl)azanium

Systemtic Name: [3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(4-benzyloxy-3,5-dibromo-phenyl)methyl]ammonium CAS Name: (3,5-dibromo-4-phenylmethoxyphenyl)methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3,5-dibromo-4-phenylmethoxyphenyl)methyl]azanium Traditional Name: (4-benzoxy-3,5-dibromo-benzyl)-benzyl-ammonium Formula: C21H20Br2NO+ MolecularWeight: 462.1976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19Br2NO/c22-19-11-18(14-24-13-16-7-3-1-4-8-16)12-20(23)21(19)25-15-17-9-5-2-6-10-17/h1-12,24H,13-15H2/p+1