(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methyl-azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methyl-azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methyl-ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methylammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methylazanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-homoveratryl-methyl-ammonium Formula: C19H25BrNO4+ MolecularWeight: 411.3101

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=CC(=C(C(=C2)Br)O)OC

Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=CC(=C(C(=C2)Br)O)OC

InChI

InChI=1S/C19H24BrNO4/c1-21(12-14-9-15(20)19(22)18(11-14)25-4)8-7-13-5-6-16(23-2)17(10-13)24-3/h5-6,9-11,22H,7-8,12H2,1-4H3/p+1