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

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-[(3,5-dimethoxyphenyl)methyl]azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-[(3,5-dimethoxyphenyl)methyl]ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-[(3,5-dimethoxyphenyl)methyl]ammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-[(3,5-dimethoxyphenyl)methyl]azanium Traditional Name: (5-bromo-2-methoxy-benzyl)-(3,5-dimethoxybenzyl)ammonium Formula: C17H21BrNO3+ MolecularWeight: 367.25754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C[NH2+]CC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C[NH2+]CC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C17H20BrNO3/c1-20-15-6-12(7-16(9-15)21-2)10-19-11-13-8-14(18)4-5-17(13)22-3/h4-9,19H,10-11H2,1-3H3/p+1