1-iodanylprop-2-ynyl 4-nitrobenzenesulfonate

Systemtic Name: 1-iodanylprop-2-ynyl 4-nitrobenzenesulfonate Openeye Name: 1-iodoprop-2-ynyl 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid 1-iodoprop-2-ynyl ester IUPAC Name: 1-iodoprop-2-ynyl 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid 1-iodoprop-2-ynyl ester Formula: C9H6INO5S MolecularWeight: 367.11711

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6INO5S/c1-2-9(10)16-17(14,15)8-5-3-7(4-6-8)11(12)13/h1,3-6,9H