methyl 3-methyl-2-(2-nitrophenyl)sulfonyloxy-butanoate

Systemtic Name: methyl 3-methyl-2-(2-nitrophenyl)sulfonyloxy-butanoate Openeye Name: methyl 3-methyl-2-(2-nitrophenyl)sulfonyloxy-butanoate CAS Name: 3-methyl-2-(2-nitrophenyl)sulfonyloxybutanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-(2-nitrophenyl)sulfonyloxybutanoate Traditional Name: 3-methyl-2-(2-nitrophenyl)sulfonyloxy-butyric acid methyl ester Formula: C12H15NO7S MolecularWeight: 317.315

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO7S/c1-8(2)11(12(14)19-3)20-21(17,18)10-7-5-4-6-9(10)13(15)16/h4-8,11H,1-3H3