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

Systemtic Name: 2-[[2-bromanyl-4-[(E)-[(3-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[2-bromo-4-[(E)-[(3-nitro-2-pyridyl)hydrazono]methyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[2-bromo-4-[(E)-[(3-nitro-2-pyridinyl)hydrazinylidene]methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[2-bromo-4-[(E)-[(3-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[2-bromo-4-[(E)-[(3-nitro-2-pyridyl)hydrazono]methyl]phenoxy]methyl]benzonitrile Formula: C20H14BrN5O3 MolecularWeight: 452.26086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)C=NNC3=C(C=CC=N3)[N+](=O)[O-])Br)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)/C=N/NC3=C(C=CC=N3)[N+](=O)[O-])Br)C#N

InChI

InChI=1S/C20H14BrN5O3/c21-17-10-14(12-24-25-20-18(26(27)28)6-3-9-23-20)7-8-19(17)29-13-16-5-2-1-4-15(16)11-22/h1-10,12H,13H2,(H,23,25)/b24-12+