[(2-nitrophenyl)sulfonylamino] 5-acetyloxy-4-oxidanylidene-pentanoate

Systemtic Name: [(2-nitrophenyl)sulfonylamino] 5-acetyloxy-4-oxidanylidene-pentanoate Openeye Name: [(2-nitrophenyl)sulfonylamino] 5-acetoxy-4-oxo-pentanoate CAS Name: 5-acetyloxy-4-oxopentanoic acid [(2-nitrophenyl)sulfonylamino] ester IUPAC Name: [(2-nitrophenyl)sulfonylamino] 5-acetyloxy-4-oxopentanoate Traditional Name: 5-acetoxy-4-keto-valeric acid [(2-nitrophenyl)sulfonylamino] ester Formula: C13H14N2O9S MolecularWeight: 374.32326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)CCC(=O)ONS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCC(=O)CCC(=O)ONS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O9S/c1-9(16)23-8-10(17)6-7-13(18)24-14-25(21,22)12-5-3-2-4-11(12)15(19)20/h2-5,14H,6-8H2,1H3