4-oxidanylidenepent-1-en-3-yl 4-nitrobenzenesulfonate

Systemtic Name: 4-oxidanylidenepent-1-en-3-yl 4-nitrobenzenesulfonate Openeye Name: 1-acetylallyl 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid 4-oxopent-1-en-3-yl ester IUPAC Name: 4-oxopent-1-en-3-yl 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid 1-acetylallyl ester Formula: C11H11NO6S MolecularWeight: 285.27314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO6S/c1-3-11(8(2)13)18-19(16,17)10-6-4-9(5-7-10)12(14)15/h3-7,11H,1H2,2H3