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

Systemtic Name: [3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl-[(4-methylphenyl)methyl]azanium Openeye Name: (4-benzyloxy-3,5-dibromo-phenyl)methyl-(p-tolylmethyl)ammonium CAS Name: (3,5-dibromo-4-phenylmethoxyphenyl)methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: (3,5-dibromo-4-phenylmethoxyphenyl)methyl-[(4-methylphenyl)methyl]azanium Traditional Name: (4-benzoxy-3,5-dibromo-benzyl)-(4-methylbenzyl)ammonium Formula: C22H22Br2NO+ MolecularWeight: 476.22418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+]CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C22H21Br2NO/c1-16-7-9-17(10-8-16)13-25-14-19-11-20(23)22(21(24)12-19)26-15-18-5-3-2-4-6-18/h2-12,25H,13-15H2,1H3/p+1