2,4-bis(oxidanylidene)pentan-3-yl (1E)-N-(4-chlorophenyl)sulfonylethanimidate

Systemtic Name: 2,4-bis(oxidanylidene)pentan-3-yl (1E)-N-(4-chlorophenyl)sulfonylethanimidate Openeye Name: (1-acetyl-2-oxo-propyl) (1E)-N-(4-chlorophenyl)sulfonylethanimidate CAS Name: (1E)-N-(4-chlorophenyl)sulfonylethanimidic acid 2,4-dioxopentan-3-yl ester IUPAC Name: 2,4-dioxopentan-3-yl (1E)-N-(4-chlorophenyl)sulfonylethanimidate Traditional Name: (1E)-N-(4-chlorophenyl)sulfonylacetimidic acid (1-acetyl-2-keto-propyl) ester Formula: C13H14ClNO5S MolecularWeight: 331.77196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)OC(=NS(=O)(=O)C1=CC=C(C=C1)Cl)C

Isomeric SMILES

CC(=O)C(C(=O)C)O/C(=N/S(=O)(=O)C1=CC=C(C=C1)Cl)/C

InChI

InChI=1S/C13H14ClNO5S/c1-8(16)13(9(2)17)20-10(3)15-21(18,19)12-6-4-11(14)5-7-12/h4-7,13H,1-3H3/b15-10+