3-nitro-4-oxidanyl-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 3-nitro-4-oxidanyl-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 4-hydroxy-3-nitro-N-prop-2-ynyl-benzenesulfonamide CAS Name: 4-hydroxy-3-nitro-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 4-hydroxy-3-nitro-N-prop-2-ynylbenzenesulfonamide Traditional Name: 4-hydroxy-3-nitro-N-propargyl-benzenesulfonamide Formula: C9H8N2O5S MolecularWeight: 256.23522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N2O5S/c1-2-5-10-17(15,16)7-3-4-9(12)8(6-7)11(13)14/h1,3-4,6,10,12H,5H2