6-bromanyl-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: 6-bromanyl-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: 6-bromo-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: 6-bromo-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 6-bromo-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: 6-bromo-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-keto-isochroman-3-carboxamide Formula: C17H10BrClF3NO3 MolecularWeight: 448.61841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10BrClF3NO3/c18-10-2-3-11-8(5-10)6-14(26-16(11)25)15(24)23-13-7-9(17(20,21)22)1-4-12(13)19/h1-5,7,14H,6H2,(H,23,24)