2-[[2-(bromomethyl)-4-nitro-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2-(bromomethyl)-4-nitro-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[2-(bromomethyl)-4-nitro-phenoxy]methyl]benzonitrile CAS Name: 2-[[2-(bromomethyl)-4-nitrophenoxy]methyl]benzonitrile IUPAC Name: 2-[[2-(bromomethyl)-4-nitrophenoxy]methyl]benzonitrile Traditional Name: 2-[[2-(bromomethyl)-4-nitro-phenoxy]methyl]benzonitrile Formula: C15H11BrN2O3 MolecularWeight: 347.16344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])CBr)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])CBr)C#N

InChI

InChI=1S/C15H11BrN2O3/c16-8-13-7-14(18(19)20)5-6-15(13)21-10-12-4-2-1-3-11(12)9-17/h1-7H,8,10H2