[azanyl(phenyl)methyl]-[2-(2-bromanyl-4-methyl-phenoxy)ethanoyloxy]azanium

Systemtic Name: [azanyl(phenyl)methyl]-[2-(2-bromanyl-4-methyl-phenoxy)ethanoyloxy]azanium Openeye Name: [amino(phenyl)methyl]-[2-(2-bromo-4-methyl-phenoxy)acetyl]oxy-ammonium CAS Name: [amino(phenyl)methyl]-[2-(2-bromo-4-methylphenoxy)-1-oxoethoxy]ammonium IUPAC Name: [amino(phenyl)methyl]-[2-(2-bromo-4-methylphenoxy)acetyl]oxyazanium Traditional Name: [amino(phenyl)methyl]-[2-(2-bromo-4-methyl-phenoxy)acetyl]oxy-ammonium Formula: C16H17BrN2O3 MolecularWeight: 365.22178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)O[NH2+][C-](C2=CC=CC=C2)N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)O[NH2+][C-](C2=CC=CC=C2)N)Br

InChI

InChI=1S/C16H17BrN2O3/c1-11-7-8-14(13(17)9-11)21-10-15(20)22-19-16(18)12-5-3-2-4-6-12/h2-9H,10,18-19H2,1H3