3-nitro-4-(4-oxidanylphenoxy)benzenecarbonitrile

Systemtic Name: 3-nitro-4-(4-oxidanylphenoxy)benzenecarbonitrile Openeye Name: 4-(4-hydroxyphenoxy)-3-nitro-benzonitrile CAS Name: 4-(4-hydroxyphenoxy)-3-nitrobenzonitrile IUPAC Name: 4-(4-hydroxyphenoxy)-3-nitrobenzonitrile Traditional Name: 4-(4-hydroxyphenoxy)-3-nitro-benzonitrile Formula: C13H8N2O4 MolecularWeight: 256.21362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1O)OC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1O)OC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H8N2O4/c14-8-9-1-6-13(12(7-9)15(17)18)19-11-4-2-10(16)3-5-11/h1-7,16H