2-oxidanylidene-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-quinoline-4-carboxamide

Systemtic Name: 2-oxidanylidene-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-quinoline-4-carboxamide Openeye Name: 2-oxo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-quinoline-4-carboxamide CAS Name: 2-oxo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-quinoline-4-carboxamide IUPAC Name: 2-oxo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-quinoline-4-carboxamide Traditional Name: 2-keto-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-quinoline-4-carboxamide Formula: C20H13F3N2O2 MolecularWeight: 370.32463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)NCC#CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)NCC#CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H13F3N2O2/c21-20(22,23)14-7-3-5-13(11-14)6-4-10-24-19(27)16-12-18(26)25-17-9-2-1-8-15(16)17/h1-3,5,7-9,11-12H,10H2,(H,24,27)(H,25,26)