[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[(2-chlorophenyl)methyl]azanium

Systemtic Name: [3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[(2-chlorophenyl)methyl]azanium Openeye Name: [3-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]methyl-[(2-chlorophenyl)methyl]ammonium CAS Name: [3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[(2-chlorophenyl)methyl]ammonium IUPAC Name: [3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[(2-chlorophenyl)methyl]azanium Traditional Name: [3-bromo-5-methoxy-4-(4-methylbenzyl)oxy-benzyl]-(2-chlorobenzyl)ammonium Formula: C23H24BrClNO2+ MolecularWeight: 461.79916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C[NH2+]CC3=CC=CC=C3Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C[NH2+]CC3=CC=CC=C3Cl)OC

InChI

InChI=1S/C23H23BrClNO2/c1-16-7-9-17(10-8-16)15-28-23-20(24)11-18(12-22(23)27-2)13-26-14-19-5-3-4-6-21(19)25/h3-12,26H,13-15H2,1-2H3/p+1