[4-[(2-bromanyl-4-ethoxy-phenoxy)methyl]phenyl]methylazanium

Systemtic Name: [4-[(2-bromanyl-4-ethoxy-phenoxy)methyl]phenyl]methylazanium Openeye Name: [4-[(2-bromo-4-ethoxy-phenoxy)methyl]phenyl]methylammonium CAS Name: [4-[(2-bromo-4-ethoxyphenoxy)methyl]phenyl]methylammonium IUPAC Name: [4-[(2-bromo-4-ethoxyphenoxy)methyl]phenyl]methylazanium Traditional Name: [4-[(2-bromo-4-ethoxy-phenoxy)methyl]benzyl]ammonium Formula: C16H19BrNO2+ MolecularWeight: 337.23156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC2=CC=C(C=C2)C[NH3+])Br

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC2=CC=C(C=C2)C[NH3+])Br

InChI

InChI=1S/C16H18BrNO2/c1-2-19-14-7-8-16(15(17)9-14)20-11-13-5-3-12(10-18)4-6-13/h3-9H,2,10-11,18H2,1H3/p+1