[4-[(Z)-2-cyano-3-oxidanylidene-but-1-enyl]-2-oxidanyl-phenyl] N,N-dimethylsulfamate

Systemtic Name: [4-[(Z)-2-cyano-3-oxidanylidene-but-1-enyl]-2-oxidanyl-phenyl] N,N-dimethylsulfamate Openeye Name: [4-[(Z)-2-cyano-3-oxo-but-1-enyl]-2-hydroxy-phenyl] N,N-dimethylsulfamate CAS Name: N,N-dimethylsulfamic acid [4-[(Z)-2-cyano-3-oxobut-1-enyl]-2-hydroxyphenyl] ester IUPAC Name: [4-[(Z)-2-cyano-3-oxobut-1-enyl]-2-hydroxyphenyl] N,N-dimethylsulfamate Traditional Name: N,N-dimethylsulfamic acid [4-[(Z)-2-cyano-3-keto-but-1-enyl]-2-hydroxy-phenyl] ester Formula: C13H14N2O5S MolecularWeight: 310.32566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=C(C=C1)OS(=O)(=O)N(C)C)O)C#N

Isomeric SMILES

CC(=O)/C(=C\C1=CC(=C(C=C1)OS(=O)(=O)N(C)C)O)/C#N

InChI

InChI=1S/C13H14N2O5S/c1-9(16)11(8-14)6-10-4-5-13(12(17)7-10)20-21(18,19)15(2)3/h4-7,17H,1-3H3/b11-6-