(5-bromanyl-2-methoxy-phenyl)methyl-[(4-cyanophenyl)methyl]-methyl-azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-[(4-cyanophenyl)methyl]-methyl-azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-[(4-cyanophenyl)methyl]-methyl-ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-[(4-cyanophenyl)methyl]-methylammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-[(4-cyanophenyl)methyl]-methylazanium Traditional Name: (5-bromo-2-methoxy-benzyl)-(4-cyanobenzyl)-methyl-ammonium Formula: C17H18BrN2O+ MolecularWeight: 346.24162

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C#N)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C#N)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C17H17BrN2O/c1-20(11-14-5-3-13(10-19)4-6-14)12-15-9-16(18)7-8-17(15)21-2/h3-9H,11-12H2,1-2H3/p+1