(E)-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: (E)-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-3-[3-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: (E)-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-3-[3-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: (E)-N-(4-methoxy-3-piperidinosulfonyl-phenyl)-3-[3-(trifluoromethyl)phenyl]acrylamide Formula: C22H23F3N2O4S MolecularWeight: 468.48923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C=CC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H23F3N2O4S/c1-31-19-10-9-18(15-20(19)32(29,30)27-12-3-2-4-13-27)26-21(28)11-8-16-6-5-7-17(14-16)22(23,24)25/h5-11,14-15H,2-4,12-13H2,1H3,(H,26,28)/b11-8+