2-oxidanylidenepent-4-enyl 4-nitrobenzenesulfonate

Systemtic Name: 2-oxidanylidenepent-4-enyl 4-nitrobenzenesulfonate Openeye Name: 2-oxopent-4-enyl 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid 2-oxopent-4-enyl ester IUPAC Name: 2-oxopent-4-enyl 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid 2-ketopent-4-enyl ester Formula: C11H11NO6S MolecularWeight: 285.27314

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(=O)COS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

C=CCC(=O)COS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H11NO6S/c1-2-3-10(13)8-18-19(16,17)11-6-4-9(5-7-11)12(14)15/h2,4-7H,1,3,8H2