(E)-3-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-[4-(difluoromethoxy)-3-methoxy-phenyl]-2-methylsulfonyl-prop-2-enenitrile CAS Name: (E)-3-[4-(difluoromethoxy)-3-methoxyphenyl]-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-[4-(difluoromethoxy)-3-methoxyphenyl]-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-3-[4-(difluoromethoxy)-3-methoxy-phenyl]-2-mesyl-acrylonitrile Formula: C12H11F2NO4S MolecularWeight: 303.281846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11F2NO4S/c1-18-11-6-8(3-4-10(11)19-12(13)14)5-9(7-15)20(2,16)17/h3-6,12H,1-2H3/b9-5+