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

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-oxo-4-(p-tolyl)isochromene-3-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(4-methylphenyl)-1-oxo-2-benzopyran-3-carboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(4-methylphenyl)-1-oxoisochromene-3-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-keto-4-(p-tolyl)isochromene-3-carboxamide Formula: C25H15F6NO3 MolecularWeight: 491.381919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C25H15F6NO3/c1-13-6-8-14(9-7-13)20-18-4-2-3-5-19(18)23(34)35-21(20)22(33)32-17-11-15(24(26,27)28)10-16(12-17)25(29,30)31/h2-12H,1H3,(H,32,33)