(5-bromanyl-3-methoxy-2-phenylmethoxy-phenyl)methyl-[(2-chlorophenyl)methyl]azanium

Systemtic Name: (5-bromanyl-3-methoxy-2-phenylmethoxy-phenyl)methyl-[(2-chlorophenyl)methyl]azanium Openeye Name: (2-benzyloxy-5-bromo-3-methoxy-phenyl)methyl-[(2-chlorophenyl)methyl]ammonium CAS Name: (5-bromo-3-methoxy-2-phenylmethoxyphenyl)methyl-[(2-chlorophenyl)methyl]ammonium IUPAC Name: (5-bromo-3-methoxy-2-phenylmethoxyphenyl)methyl-[(2-chlorophenyl)methyl]azanium Traditional Name: (2-benzoxy-5-bromo-3-methoxy-benzyl)-(2-chlorobenzyl)ammonium Formula: C22H22BrClNO2+ MolecularWeight: 447.77258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C[NH2+]CC2=CC=CC=C2Cl)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C[NH2+]CC2=CC=CC=C2Cl)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21BrClNO2/c1-26-21-12-19(23)11-18(14-25-13-17-9-5-6-10-20(17)24)22(21)27-15-16-7-3-2-4-8-16/h2-12,25H,13-15H2,1H3/p+1