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

Systemtic Name: [azanyl-(3-nitrophenyl)methylidene]-[2-(4-bromanyl-3,5-dimethyl-phenoxy)ethanoyloxy]azanium Openeye Name: [amino-(3-nitrophenyl)methylene]-[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]oxy-ammonium CAS Name: [amino-(3-nitrophenyl)methylidene]-[2-(4-bromo-3,5-dimethylphenoxy)-1-oxoethoxy]ammonium IUPAC Name: [amino-(3-nitrophenyl)methylidene]-[2-(4-bromo-3,5-dimethylphenoxy)acetyl]oxyazanium Traditional Name: [amino-(3-nitrophenyl)methylene]-[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]oxy-ammonium Formula: C17H17BrN3O5+ MolecularWeight: 423.23798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O5/c1-10-6-14(7-11(2)16(10)18)25-9-15(22)26-20-17(19)12-4-3-5-13(8-12)21(23)24/h3-8H,9H2,1-2H3,(H2,19,20)/p+1