N-[4-(3-cyano-4-oxidanylidene-pentanoyl)phenyl]methanesulfonamide

Systemtic Name: N-[4-(3-cyano-4-oxidanylidene-pentanoyl)phenyl]methanesulfonamide Openeye Name: N-[4-(3-cyano-4-oxo-pentanoyl)phenyl]methanesulfonamide CAS Name: N-[4-(3-cyano-1,4-dioxopentyl)phenyl]methanesulfonamide IUPAC Name: N-[4-(3-cyano-4-oxopentanoyl)phenyl]methanesulfonamide Traditional Name: N-[4-(3-cyano-4-keto-pentanoyl)phenyl]methanesulfonamide Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC(=O)C1=CC=C(C=C1)NS(=O)(=O)C)C#N

Isomeric SMILES

CC(=O)C(CC(=O)C1=CC=C(C=C1)NS(=O)(=O)C)C#N

InChI

InChI=1S/C13H14N2O4S/c1-9(16)11(8-14)7-13(17)10-3-5-12(6-4-10)15-20(2,18)19/h3-6,11,15H,7H2,1-2H3