2-[[2-bromanyl-6-ethoxy-4-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2-bromanyl-6-ethoxy-4-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[2-bromo-6-ethoxy-4-[(E)-[(5-nitro-2-pyridyl)hydrazono]methyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[2-bromo-6-ethoxy-4-[(E)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[2-bromo-6-ethoxy-4-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[2-bromo-6-ethoxy-4-[(E)-[(5-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(=CC(=C1)C=NNC2=NC=C(C=C2)[N+](=O)[O-])Br)OCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=N/NC2=NC=C(C=C2)[N+](=O)[O-])Br)OCC3=CC=CC=C3C#N

InChI

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