2-[[(5-bromanyl-2,4-dimethoxy-phenyl)methylideneamino]carbamoyl]-4-nitro-phenolate

Systemtic Name: 2-[[(5-bromanyl-2,4-dimethoxy-phenyl)methylideneamino]carbamoyl]-4-nitro-phenolate Openeye Name: 2-[[(5-bromo-2,4-dimethoxy-phenyl)methyleneamino]carbamoyl]-4-nitro-phenolate CAS Name: 2-[[2-[(5-bromo-2,4-dimethoxyphenyl)methylidene]hydrazinyl]-oxomethyl]-4-nitrophenolate IUPAC Name: 2-[[(5-bromo-2,4-dimethoxyphenyl)methylideneamino]carbamoyl]-4-nitrophenolate Traditional Name: 2-[[(5-bromo-2,4-dimethoxy-benzylidene)amino]carbamoyl]-4-nitro-phenolate Formula: C16H13BrN3O6- MolecularWeight: 423.19492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=NNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])[O-])Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C=NNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])[O-])Br)OC

InChI

InChI=1S/C16H14BrN3O6/c1-25-14-7-15(26-2)12(17)5-9(14)8-18-19-16(22)11-6-10(20(23)24)3-4-13(11)21/h3-8,21H,1-2H3,(H,19,22)/p-1