N-[3-cyano-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[3-cyano-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-4-methylsulfonyl-benzamide Openeye Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-methylsulfonyl-benzamide CAS Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-methylsulfonylbenzamide IUPAC Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-methylsulfonylbenzamide Traditional Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-mesyl-benzamide Formula: C17H13F3N2O4S MolecularWeight: 398.35633

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)OCC(F)(F)F)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)OCC(F)(F)F)C#N

InChI

InChI=1S/C17H13F3N2O4S/c1-27(24,25)14-5-2-11(3-6-14)16(23)22-13-4-7-15(12(8-13)9-21)26-10-17(18,19)20/h2-8H,10H2,1H3,(H,22,23)