2-(3-nitro-4-phenylmethoxy-phenoxy)ethanenitrile

Systemtic Name: 2-(3-nitro-4-phenylmethoxy-phenoxy)ethanenitrile Openeye Name: 2-(4-benzyloxy-3-nitro-phenoxy)acetonitrile CAS Name: 2-(3-nitro-4-phenylmethoxyphenoxy)acetonitrile IUPAC Name: 2-(3-nitro-4-phenylmethoxyphenoxy)acetonitrile Traditional Name: 2-(4-benzoxy-3-nitro-phenoxy)acetonitrile Formula: C15H12N2O4 MolecularWeight: 284.26678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N2O4/c16-8-9-20-13-6-7-15(14(10-13)17(18)19)21-11-12-4-2-1-3-5-12/h1-7,10H,9,11H2