(Z)-5-[(4-methylsulfonylphenyl)amino]-5-oxidanyl-3-oxidanylidene-pent-4-enenitrile

Systemtic Name: (Z)-5-[(4-methylsulfonylphenyl)amino]-5-oxidanyl-3-oxidanylidene-pent-4-enenitrile Openeye Name: (Z)-5-hydroxy-5-(4-methylsulfonylanilino)-3-oxo-pent-4-enenitrile CAS Name: (Z)-5-hydroxy-5-(4-methylsulfonylanilino)-3-oxo-4-pentenenitrile IUPAC Name: (Z)-5-hydroxy-5-(4-methylsulfonylanilino)-3-oxopent-4-enenitrile Traditional Name: (Z)-5-hydroxy-3-keto-5-(4-mesylanilino)pent-4-enenitrile Formula: C12H12N2O4S MolecularWeight: 280.29968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=CC(=O)CC#N)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N/C(=C/C(=O)CC#N)/O

InChI

InChI=1S/C12H12N2O4S/c1-19(17,18)11-4-2-9(3-5-11)14-12(16)8-10(15)6-7-13/h2-5,8,14,16H,6H2,1H3/b12-8-