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

Systemtic Name: 2-(4-nitro-3-phenylmethoxy-phenyl)ethanenitrile Openeye Name: 2-(3-benzyloxy-4-nitro-phenyl)acetonitrile CAS Name: 2-(4-nitro-3-phenylmethoxyphenyl)acetonitrile IUPAC Name: 2-(4-nitro-3-phenylmethoxyphenyl)acetonitrile Traditional Name: 2-(3-benzoxy-4-nitro-phenyl)acetonitrile Formula: C15H12N2O3 MolecularWeight: 268.26738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N2O3/c16-9-8-12-6-7-14(17(18)19)15(10-12)20-11-13-4-2-1-3-5-13/h1-7,10H,8,11H2