(3S)-1-oxidanylidene-N-[4-(trifluoromethyloxy)phenyl]-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3S)-1-oxidanylidene-N-[4-(trifluoromethyloxy)phenyl]-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3S)-1-oxo-N-[4-(trifluoromethoxy)phenyl]isochromane-3-carboxamide CAS Name: (3S)-1-oxo-N-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-1-oxo-N-[4-(trifluoromethoxy)phenyl]-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3S)-1-keto-N-[4-(trifluoromethoxy)phenyl]isochroman-3-carboxamide Formula: C17H12F3NO4 MolecularWeight: 351.27669

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1[C@H](OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C17H12F3NO4/c18-17(19,20)25-12-7-5-11(6-8-12)21-15(22)14-9-10-3-1-2-4-13(10)16(23)24-14/h1-8,14H,9H2,(H,21,22)/t14-/m0/s1