2-(3,4-dimethoxyphenyl)sulfonylethanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfonylethanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)sulfonylacetonitrile CAS Name: 2-(3,4-dimethoxyphenyl)sulfonylacetonitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfonylacetonitrile Traditional Name: 2-(3,4-dimethoxyphenyl)sulfonylacetonitrile Formula: C10H11NO4S MolecularWeight: 241.26364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)CC#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)CC#N)OC

InChI

InChI=1S/C10H11NO4S/c1-14-9-4-3-8(7-10(9)15-2)16(12,13)6-5-11/h3-4,7H,6H2,1-2H3