N-[4-oxidanylidene-4-[3-[3-(trifluoromethyl)phenyl]prop-2-ynylamino]butan-2-yl]benzamide

Systemtic Name: N-[4-oxidanylidene-4-[3-[3-(trifluoromethyl)phenyl]prop-2-ynylamino]butan-2-yl]benzamide Openeye Name: N-[1-methyl-3-oxo-3-[3-[3-(trifluoromethyl)phenyl]prop-2-ynylamino]propyl]benzamide CAS Name: N-[4-oxo-4-[3-[3-(trifluoromethyl)phenyl]prop-2-ynylamino]butan-2-yl]benzamide IUPAC Name: N-[4-oxo-4-[3-[3-(trifluoromethyl)phenyl]prop-2-ynylamino]butan-2-yl]benzamide Traditional Name: N-[3-keto-1-methyl-3-[3-[3-(trifluoromethyl)phenyl]prop-2-ynylamino]propyl]benzamide Formula: C21H19F3N2O2 MolecularWeight: 388.38297

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC#CC1=CC(=CC=C1)C(F)(F)F)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)NCC#CC1=CC(=CC=C1)C(F)(F)F)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H19F3N2O2/c1-15(26-20(28)17-9-3-2-4-10-17)13-19(27)25-12-6-8-16-7-5-11-18(14-16)21(22,23)24/h2-5,7,9-11,14-15H,12-13H2,1H3,(H,25,27)(H,26,28)