[azanyl(phenyl)methyl]-[2-(4-bromanyl-3,5-dimethyl-phenoxy)ethanoyloxy]azanium

Systemtic Name: [azanyl(phenyl)methyl]-[2-(4-bromanyl-3,5-dimethyl-phenoxy)ethanoyloxy]azanium Openeye Name: [amino(phenyl)methyl]-[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]oxy-ammonium CAS Name: [amino(phenyl)methyl]-[2-(4-bromo-3,5-dimethylphenoxy)-1-oxoethoxy]ammonium IUPAC Name: [amino(phenyl)methyl]-[2-(4-bromo-3,5-dimethylphenoxy)acetyl]oxyazanium Traditional Name: [amino(phenyl)methyl]-[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]oxy-ammonium Formula: C17H19BrN2O3 MolecularWeight: 379.24836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Br)C)OCC(=O)O[NH2+][C-](C2=CC=CC=C2)N

Isomeric SMILES

CC1=CC(=CC(=C1Br)C)OCC(=O)O[NH2+][C-](C2=CC=CC=C2)N

InChI

InChI=1S/C17H19BrN2O3/c1-11-8-14(9-12(2)16(11)18)22-10-15(21)23-20-17(19)13-6-4-3-5-7-13/h3-9H,10,19-20H2,1-2H3