[2-(2-azanyl-2-oxidanylidene-ethoxy)-5-bromanyl-phenyl]methyl-(phenylmethyl)azanium

Systemtic Name: [2-(2-azanyl-2-oxidanylidene-ethoxy)-5-bromanyl-phenyl]methyl-(phenylmethyl)azanium Openeye Name: [2-(2-amino-2-oxo-ethoxy)-5-bromo-phenyl]methyl-benzyl-ammonium CAS Name: [2-(2-amino-2-oxoethoxy)-5-bromophenyl]methyl-(phenylmethyl)ammonium IUPAC Name: [2-(2-amino-2-oxoethoxy)-5-bromophenyl]methyl-benzylazanium Traditional Name: [2-(2-amino-2-keto-ethoxy)-5-bromo-benzyl]-benzyl-ammonium Formula: C16H18BrN2O2+ MolecularWeight: 350.23032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]CC2=C(C=CC(=C2)Br)OCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]CC2=C(C=CC(=C2)Br)OCC(=O)N

InChI

InChI=1S/C16H17BrN2O2/c17-14-6-7-15(21-11-16(18)20)13(8-14)10-19-9-12-4-2-1-3-5-12/h1-8,19H,9-11H2,(H2,18,20)/p+1