(E)-4-(oxan-2-yloxy)-2-(phenylsulfonylmethyl)but-2-enenitrile

Systemtic Name: (E)-4-(oxan-2-yloxy)-2-(phenylsulfonylmethyl)but-2-enenitrile Openeye Name: (E)-2-(benzenesulfonylmethyl)-4-tetrahydropyran-2-yloxy-but-2-enenitrile CAS Name: (E)-2-(benzenesulfonylmethyl)-4-(2-oxanyloxy)-2-butenenitrile IUPAC Name: (E)-2-(benzenesulfonylmethyl)-4-(oxan-2-yloxy)but-2-enenitrile Traditional Name: (E)-2-(besylmethyl)-4-tetrahydropyran-2-yloxy-but-2-enenitrile Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCC=C(CS(=O)(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

C1CCOC(C1)OC/C=C(/CS(=O)(=O)C2=CC=CC=C2)\C#N

InChI

InChI=1S/C16H19NO4S/c17-12-14(9-11-21-16-8-4-5-10-20-16)13-22(18,19)15-6-2-1-3-7-15/h1-3,6-7,9,16H,4-5,8,10-11,13H2/b14-9+