ethyl 3-(4-nitrophenyl)sulfonyloxy-4-oxidanylidene-pentanoate

Systemtic Name: ethyl 3-(4-nitrophenyl)sulfonyloxy-4-oxidanylidene-pentanoate Openeye Name: ethyl 3-(4-nitrophenyl)sulfonyloxy-4-oxo-pentanoate CAS Name: 3-(4-nitrophenyl)sulfonyloxy-4-oxopentanoic acid ethyl ester IUPAC Name: ethyl 3-(4-nitrophenyl)sulfonyloxy-4-oxopentanoate Traditional Name: 4-keto-3-nosyloxy-valeric acid ethyl ester Formula: C13H15NO8S MolecularWeight: 345.3251

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO8S/c1-3-21-13(16)8-12(9(2)15)22-23(19,20)11-6-4-10(5-7-11)14(17)18/h4-7,12H,3,8H2,1-2H3