3,6-dimethyl-1-oxidanylidene-N-[2-(trifluoromethyl)phenyl]-4H-isochromene-3-carboxamide

Systemtic Name: 3,6-dimethyl-1-oxidanylidene-N-[2-(trifluoromethyl)phenyl]-4H-isochromene-3-carboxamide Openeye Name: 3,6-dimethyl-1-oxo-N-[2-(trifluoromethyl)phenyl]isochromane-3-carboxamide CAS Name: 3,6-dimethyl-1-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 3,6-dimethyl-1-oxo-N-[2-(trifluoromethyl)phenyl]-4H-isochromene-3-carboxamide Traditional Name: 1-keto-3,6-dimethyl-N-[2-(trifluoromethyl)phenyl]isochroman-3-carboxamide Formula: C19H16F3NO3 MolecularWeight: 363.33045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H16F3NO3/c1-11-7-8-13-12(9-11)10-18(2,26-16(13)24)17(25)23-15-6-4-3-5-14(15)19(20,21)22/h3-9H,10H2,1-2H3,(H,23,25)