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

Systemtic Name: (6-bromanyl-2-oxidanyl-naphthalen-1-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: (6-bromo-2-hydroxy-1-naphthyl)methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: (6-bromo-2-hydroxy-1-naphthalenyl)methyl-[(3,4-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: (6-bromo-2-hydroxynaphthalen-1-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methylazanium Traditional Name: (6-bromo-2-hydroxy-1-naphthyl)methyl-methyl-veratryl-ammonium Formula: C21H23BrNO3+ MolecularWeight: 417.31622

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C=C1)OC)OC)CC2=C(C=CC3=C2C=CC(=C3)Br)O

Isomeric SMILES

C[NH+](CC1=CC(=C(C=C1)OC)OC)CC2=C(C=CC3=C2C=CC(=C3)Br)O

InChI

InChI=1S/C21H22BrNO3/c1-23(12-14-4-9-20(25-2)21(10-14)26-3)13-18-17-7-6-16(22)11-15(17)5-8-19(18)24/h4-11,24H,12-13H2,1-3H3/p+1