acetamido 3-oxidanylidene-4-phenyl-2-sulfonyl-butanoate

Systemtic Name: acetamido 3-oxidanylidene-4-phenyl-2-sulfonyl-butanoate Openeye Name: acetamido 3-oxo-4-phenyl-2-sulfonyl-butanoate CAS Name: 3-oxo-4-phenyl-2-sulfonylbutanoic acid acetamido ester IUPAC Name: acetamido 3-oxo-4-phenyl-2-sulfonylbutanoate Traditional Name: 3-keto-4-phenyl-2-sulfonyl-butyric acid acetamido ester Formula: C12H11NO6S MolecularWeight: 297.28384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NOC(=O)C(=S(=O)=O)C(=O)CC1=CC=CC=C1

Isomeric SMILES

CC(=O)NOC(=O)C(=S(=O)=O)C(=O)CC1=CC=CC=C1

InChI

InChI=1S/C12H11NO6S/c1-8(14)13-19-12(16)11(20(17)18)10(15)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,13,14)