3-[[(E)-3-quinolin-8-ylprop-2-enoyl]amino]-N-[2,2,2-tris(fluoranyl)ethyl]benzamide

Systemtic Name: 3-[[(E)-3-quinolin-8-ylprop-2-enoyl]amino]-N-[2,2,2-tris(fluoranyl)ethyl]benzamide Openeye Name: 3-[[(E)-3-(8-quinolyl)prop-2-enoyl]amino]-N-(2,2,2-trifluoroethyl)benzamide CAS Name: 3-[[(E)-1-oxo-3-(8-quinolinyl)prop-2-enyl]amino]-N-(2,2,2-trifluoroethyl)benzamide IUPAC Name: 3-[[(E)-3-quinolin-8-ylprop-2-enoyl]amino]-N-(2,2,2-trifluoroethyl)benzamide Traditional Name: 3-[[(E)-3-(8-quinolyl)acryloyl]amino]-N-(2,2,2-trifluoroethyl)benzamide Formula: C21H16F3N3O2 MolecularWeight: 399.36585

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C=CC(=O)NC3=CC=CC(=C3)C(=O)NCC(F)(F)F)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)/C=C/C(=O)NC3=CC=CC(=C3)C(=O)NCC(F)(F)F)N=CC=C2

InChI

InChI=1S/C21H16F3N3O2/c22-21(23,24)13-26-20(29)16-6-2-8-17(12-16)27-18(28)10-9-15-5-1-4-14-7-3-11-25-19(14)15/h1-12H,13H2,(H,26,29)(H,27,28)/b10-9+