(3-bromanyl-4-phenylmethoxy-phenyl)methyl-(2-methoxyethyl)azanium

Systemtic Name: (3-bromanyl-4-phenylmethoxy-phenyl)methyl-(2-methoxyethyl)azanium Openeye Name: (4-benzyloxy-3-bromo-phenyl)methyl-(2-methoxyethyl)ammonium CAS Name: (3-bromo-4-phenylmethoxyphenyl)methyl-(2-methoxyethyl)ammonium IUPAC Name: (3-bromo-4-phenylmethoxyphenyl)methyl-(2-methoxyethyl)azanium Traditional Name: (4-benzoxy-3-bromo-benzyl)-(2-methoxyethyl)ammonium Formula: C17H21BrNO2+ MolecularWeight: 351.25814

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CC=C2)Br

Isomeric SMILES

COCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C17H20BrNO2/c1-20-10-9-19-12-15-7-8-17(16(18)11-15)21-13-14-5-3-2-4-6-14/h2-8,11,19H,9-10,12-13H2,1H3/p+1