(3S)-N-[3,5-bis(trifluoromethyl)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3S)-N-[3,5-bis(trifluoromethyl)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3S)-N-[3,5-bis(trifluoromethyl)phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-[3,5-bis(trifluoromethyl)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-[3,5-bis(trifluoromethyl)phenyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3S)-N-[3,5-bis(trifluoromethyl)phenyl]-1-keto-isochroman-3-carboxamide Formula: C18H11F6NO3 MolecularWeight: 403.275259

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H11F6NO3/c19-17(20,21)10-6-11(18(22,23)24)8-12(7-10)25-15(26)14-5-9-3-1-2-4-13(9)16(27)28-14/h1-4,6-8,14H,5H2,(H,25,26)/t14-/m0/s1