(E)-1-cyano-2-(3,5-dimethyl-4-oxidanyl-phenyl)-N-(phenylmethyl)ethenesulfonamide

Systemtic Name: (E)-1-cyano-2-(3,5-dimethyl-4-oxidanyl-phenyl)-N-(phenylmethyl)ethenesulfonamide Openeye Name: (E)-N-benzyl-1-cyano-2-(4-hydroxy-3,5-dimethyl-phenyl)ethenesulfonamide CAS Name: (E)-1-cyano-2-(4-hydroxy-3,5-dimethylphenyl)-N-(phenylmethyl)ethenesulfonamide IUPAC Name: (E)-N-benzyl-1-cyano-2-(4-hydroxy-3,5-dimethylphenyl)ethenesulfonamide Traditional Name: (E)-N-benzyl-1-cyano-2-(4-hydroxy-3,5-dimethyl-phenyl)ethenesulfonamide Formula: C18H18N2O3S MolecularWeight: 342.41212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C=C(C#N)S(=O)(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=CC(=C1O)C)/C=C(\C#N)/S(=O)(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O3S/c1-13-8-16(9-14(2)18(13)21)10-17(11-19)24(22,23)20-12-15-6-4-3-5-7-15/h3-10,20-21H,12H2,1-2H3/b17-10+