5-nitro-2-(phenylsulfonyl)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(phenylsulfonyl)benzenecarbonitrile Openeye Name: 2-(benzenesulfonyl)-5-nitro-benzonitrile CAS Name: 2-(benzenesulfonyl)-5-nitrobenzonitrile IUPAC Name: 2-(benzenesulfonyl)-5-nitrobenzonitrile Traditional Name: 2-besyl-5-nitro-benzonitrile Formula: C13H8N2O4S MolecularWeight: 288.27862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8N2O4S/c14-9-10-8-11(15(16)17)6-7-13(10)20(18,19)12-4-2-1-3-5-12/h1-8H