[(3R)-3-cyano-5-[3-(methylsulfamoyl)phenyl]carbonyloxy-4-oxidanylidene-pent-1-en-2-yl]azanium

Systemtic Name: [(3R)-3-cyano-5-[3-(methylsulfamoyl)phenyl]carbonyloxy-4-oxidanylidene-pent-1-en-2-yl]azanium Openeye Name: [(2R)-2-cyano-1-methylene-4-[3-(methylsulfamoyl)benzoyl]oxy-3-oxo-butyl]ammonium CAS Name: [(3R)-3-cyano-5-[[3-(methylsulfamoyl)phenyl]-oxomethoxy]-4-oxopent-1-en-2-yl]ammonium IUPAC Name: [(3R)-3-cyano-5-[3-(methylsulfamoyl)benzoyl]oxy-4-oxopent-1-en-2-yl]azanium Traditional Name: 1-[(1R)-1-cyano-2-keto-3-[3-(methylsulfamoyl)benzoyl]oxy-propyl]vinylammonium Formula: C14H16N3O5S+ MolecularWeight: 338.35894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)C(C#N)C(=C)[NH3+]

Isomeric SMILES

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)[C@@H](C#N)C(=C)[NH3+]

InChI

InChI=1S/C14H15N3O5S/c1-9(16)12(7-15)13(18)8-22-14(19)10-4-3-5-11(6-10)23(20,21)17-2/h3-6,12,17H,1,8,16H2,2H3/p+1/t12-/m0/s1