(5-bromanyl-3-methoxy-2-phenylmethoxy-phenyl)methyl-[2-(4-methoxyphenyl)ethyl]azanium

Systemtic Name: (5-bromanyl-3-methoxy-2-phenylmethoxy-phenyl)methyl-[2-(4-methoxyphenyl)ethyl]azanium Openeye Name: (2-benzyloxy-5-bromo-3-methoxy-phenyl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium CAS Name: (5-bromo-3-methoxy-2-phenylmethoxyphenyl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium IUPAC Name: (5-bromo-3-methoxy-2-phenylmethoxyphenyl)methyl-[2-(4-methoxyphenyl)ethyl]azanium Traditional Name: (2-benzoxy-5-bromo-3-methoxy-benzyl)-[2-(4-methoxyphenyl)ethyl]ammonium Formula: C24H27BrNO3+ MolecularWeight: 457.38008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC[NH2+]CC2=CC(=CC(=C2OCC3=CC=CC=C3)OC)Br

Isomeric SMILES

COC1=CC=C(C=C1)CC[NH2+]CC2=CC(=CC(=C2OCC3=CC=CC=C3)OC)Br

InChI

InChI=1S/C24H26BrNO3/c1-27-22-10-8-18(9-11-22)12-13-26-16-20-14-21(25)15-23(28-2)24(20)29-17-19-6-4-3-5-7-19/h3-11,14-15,26H,12-13,16-17H2,1-2H3/p+1