(3-bromanyl-4-methoxy-phenyl)methyl-(2-hydroxyethyl)-(phenylmethyl)azanium

Systemtic Name: (3-bromanyl-4-methoxy-phenyl)methyl-(2-hydroxyethyl)-(phenylmethyl)azanium Openeye Name: benzyl-[(3-bromo-4-methoxy-phenyl)methyl]-(2-hydroxyethyl)ammonium CAS Name: (3-bromo-4-methoxyphenyl)methyl-(2-hydroxyethyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3-bromo-4-methoxyphenyl)methyl]-(2-hydroxyethyl)azanium Traditional Name: benzyl-(3-bromo-4-methoxy-benzyl)-(2-hydroxyethyl)ammonium Formula: C17H21BrNO2+ MolecularWeight: 351.25814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+](CCO)CC2=CC=CC=C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+](CCO)CC2=CC=CC=C2)Br

InChI

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