5-nitro-2-(3-nitrophenoxy)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(3-nitrophenoxy)benzenecarbonitrile Openeye Name: 5-nitro-2-(3-nitrophenoxy)benzonitrile CAS Name: 5-nitro-2-(3-nitrophenoxy)benzonitrile IUPAC Name: 5-nitro-2-(3-nitrophenoxy)benzonitrile Traditional Name: 5-nitro-2-(3-nitrophenoxy)benzonitrile Formula: C13H7N3O5 MolecularWeight: 285.21178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H7N3O5/c14-8-9-6-11(16(19)20)4-5-13(9)21-12-3-1-2-10(7-12)15(17)18/h1-7H