2-cyclopropylcarbonyl-3-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]-3-oxidanylidene-propanenitrile

Systemtic Name: 2-cyclopropylcarbonyl-3-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]-3-oxidanylidene-propanenitrile Openeye Name: 2-(cyclopropanecarbonyl)-3-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]-3-oxo-propanenitrile CAS Name: 2-[cyclopropyl(oxo)methyl]-3-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]-3-oxopropanenitrile IUPAC Name: 2-(cyclopropanecarbonyl)-3-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]-3-oxopropanenitrile Traditional Name: 2-(cyclopropanecarbonyl)-3-keto-3-[2-mesyl-4-(trifluoromethyl)phenyl]propionitrile Formula: C15H12F3NO4S MolecularWeight: 359.32029

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C(C#N)C(=O)C2CC2

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C(C#N)C(=O)C2CC2

InChI

InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3