N-[2-chloranyl-5-(trifluoromethyl)phenyl]-3,6-dimethyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-3,6-dimethyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3,6-dimethyl-1-oxo-isochromane-3-carboxamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3,6-dimethyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3,6-dimethyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-1-keto-3,6-dimethyl-isochroman-3-carboxamide Formula: C19H15ClF3NO3 MolecularWeight: 397.77551

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C19H15ClF3NO3/c1-10-3-5-13-11(7-10)9-18(2,27-16(13)25)17(26)24-15-8-12(19(21,22)23)4-6-14(15)20/h3-8H,9H2,1-2H3,(H,24,26)