6-bromanyl-1-oxidanylidene-N-[3-(trifluoromethyl)phenyl]-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: 6-bromanyl-1-oxidanylidene-N-[3-(trifluoromethyl)phenyl]-3,4-dihydroisochromene-3-carboxamide Openeye Name: 6-bromo-1-oxo-N-[3-(trifluoromethyl)phenyl]isochromane-3-carboxamide CAS Name: 6-bromo-1-oxo-N-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 6-bromo-1-oxo-N-[3-(trifluoromethyl)phenyl]-3,4-dihydroisochromene-3-carboxamide Traditional Name: 6-bromo-1-keto-N-[3-(trifluoromethyl)phenyl]isochroman-3-carboxamide Formula: C17H11BrF3NO3 MolecularWeight: 414.17335

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11BrF3NO3/c18-11-4-5-13-9(6-11)7-14(25-16(13)24)15(23)22-12-3-1-2-10(8-12)17(19,20)21/h1-6,8,14H,7H2,(H,22,23)