(6-bromanyl-2-oxidanyl-naphthalen-1-yl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methyl-azanium

Systemtic Name: (6-bromanyl-2-oxidanyl-naphthalen-1-yl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methyl-azanium Openeye Name: (6-bromo-2-hydroxy-1-naphthyl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methyl-ammonium CAS Name: (6-bromo-2-hydroxy-1-naphthalenyl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methylammonium IUPAC Name: (6-bromo-2-hydroxynaphthalen-1-yl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]-methylazanium Traditional Name: (6-bromo-2-hydroxy-1-naphthyl)methyl-homoveratryl-methyl-ammonium Formula: C22H25BrNO3+ MolecularWeight: 431.3428

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=C(C=CC3=C2C=CC(=C3)Br)O

Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=C(C=CC3=C2C=CC(=C3)Br)O

InChI

InChI=1S/C22H24BrNO3/c1-24(11-10-15-4-9-21(26-2)22(12-15)27-3)14-19-18-7-6-17(23)13-16(18)5-8-20(19)25/h4-9,12-13,25H,10-11,14H2,1-3H3/p+1