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

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-1-oxidanylidene-4-phenyl-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-1-oxo-4-phenyl-isochromane-3-carboxamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-1-oxo-4-phenyl-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-1-oxo-4-phenyl-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-1-keto-N-methyl-4-phenyl-isochroman-3-carboxamide Formula: C26H19F6NO3 MolecularWeight: 507.424379

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(=O)C2C(C3=CC=CC=C3C(=O)O2)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(=O)C2C(C3=CC=CC=C3C(=O)O2)C4=CC=CC=C4

InChI

InChI=1S/C26H19F6NO3/c1-33(14-15-11-17(25(27,28)29)13-18(12-15)26(30,31)32)23(34)22-21(16-7-3-2-4-8-16)19-9-5-6-10-20(19)24(35)36-22/h2-13,21-22H,14H2,1H3