2-(2-nitrophenyl)-2-sulfonyl-ethanenitrile

Systemtic Name: 2-(2-nitrophenyl)-2-sulfonyl-ethanenitrile Openeye Name: 2-(2-nitrophenyl)-2-sulfonyl-acetonitrile CAS Name: 2-(2-nitrophenyl)-2-sulfonylacetonitrile IUPAC Name: 2-(2-nitrophenyl)-2-sulfonylacetonitrile Traditional Name: 2-(2-nitrophenyl)-2-sulfonyl-acetonitrile Formula: C8H4N2O4S MolecularWeight: 224.19336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H4N2O4S/c9-5-8(15(13)14)6-3-1-2-4-7(6)10(11)12/h1-4H