2-[[5-bromanyl-2-ethoxy-4-[(E)-[(3-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[5-bromanyl-2-ethoxy-4-[(E)-[(3-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[5-bromo-2-ethoxy-4-[(E)-[(3-nitro-2-pyridyl)hydrazono]methyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[5-bromo-2-ethoxy-4-[(E)-[(3-nitro-2-pyridinyl)hydrazinylidene]methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[5-bromo-2-ethoxy-4-[(E)-[(3-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[5-bromo-2-ethoxy-4-[(E)-[(3-nitro-2-pyridyl)hydrazono]methyl]phenoxy]methyl]benzonitrile Formula: C22H18BrN5O4 MolecularWeight: 496.31342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=NNC2=C(C=CC=N2)[N+](=O)[O-])Br)OCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=C(C=C(C(=C1)/C=N/NC2=C(C=CC=N2)[N+](=O)[O-])Br)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C22H18BrN5O4/c1-2-31-20-10-17(13-26-27-22-19(28(29)30)8-5-9-25-22)18(23)11-21(20)32-14-16-7-4-3-6-15(16)12-24/h3-11,13H,2,14H2,1H3,(H,25,27)/b26-13+