2-(nitromethylsulfonyl)-N-phenyl-cyclohexa-1,3-diene-1-sulfonamide

Systemtic Name: 2-(nitromethylsulfonyl)-N-phenyl-cyclohexa-1,3-diene-1-sulfonamide Openeye Name: 2-(nitromethylsulfonyl)-N-phenyl-cyclohexa-1,3-diene-1-sulfonamide CAS Name: 2-(nitromethylsulfonyl)-N-phenyl-1-cyclohexa-1,3-dienesulfonamide IUPAC Name: 2-(nitromethylsulfonyl)-N-phenylcyclohexa-1,3-diene-1-sulfonamide Traditional Name: 2-(nitromethylsulfonyl)-N-phenyl-cyclohexa-1,3-diene-1-sulfonamide Formula: C13H14N2O6S2 MolecularWeight: 358.39006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C=C1)S(=O)(=O)C[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2

Isomeric SMILES

C1CC(=C(C=C1)S(=O)(=O)C[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O6S2/c16-15(17)10-22(18,19)12-8-4-5-9-13(12)23(20,21)14-11-6-2-1-3-7-11/h1-4,6-8,14H,5,9-10H2