[4-[(4-bromanyl-3-methoxy-phenoxy)methyl]phenyl]methylazanium

Systemtic Name: [4-[(4-bromanyl-3-methoxy-phenoxy)methyl]phenyl]methylazanium Openeye Name: [4-[(4-bromo-3-methoxy-phenoxy)methyl]phenyl]methylammonium CAS Name: [4-[(4-bromo-3-methoxyphenoxy)methyl]phenyl]methylammonium IUPAC Name: [4-[(4-bromo-3-methoxyphenoxy)methyl]phenyl]methylazanium Traditional Name: [4-[(4-bromo-3-methoxy-phenoxy)methyl]benzyl]ammonium Formula: C15H17BrNO2+ MolecularWeight: 323.20498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC2=CC=C(C=C2)C[NH3+])Br

Isomeric SMILES

COC1=C(C=CC(=C1)OCC2=CC=C(C=C2)C[NH3+])Br

InChI

InChI=1S/C15H16BrNO2/c1-18-15-8-13(6-7-14(15)16)19-10-12-4-2-11(9-17)3-5-12/h2-8H,9-10,17H2,1H3/p+1