6-[[4-(1,3-dihydroisoindol-2-ylsulfonyl)phenyl]methyl]-4-(trifluoromethyl)chromen-2-one

Systemtic Name: 6-[[4-(1,3-dihydroisoindol-2-ylsulfonyl)phenyl]methyl]-4-(trifluoromethyl)chromen-2-one Openeye Name: 6-[(4-isoindolin-2-ylsulfonylphenyl)methyl]-4-(trifluoromethyl)chromen-2-one CAS Name: 6-[[4-(1,3-dihydroisoindol-2-ylsulfonyl)phenyl]methyl]-4-(trifluoromethyl)-1-benzopyran-2-one IUPAC Name: 6-[[4-(1,3-dihydroisoindol-2-ylsulfonyl)phenyl]methyl]-4-(trifluoromethyl)chromen-2-one Traditional Name: 6-(4-isoindolin-2-ylsulfonylbenzyl)-4-(trifluoromethyl)coumarin Formula: C25H18F3NO4S MolecularWeight: 485.47493

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN1S(=O)(=O)C3=CC=C(C=C3)CC4=CC5=C(C=C4)OC(=O)C=C5C(F)(F)F

Isomeric SMILES

C1C2=CC=CC=C2CN1S(=O)(=O)C3=CC=C(C=C3)CC4=CC5=C(C=C4)OC(=O)C=C5C(F)(F)F

InChI

InChI=1S/C25H18F3NO4S/c26-25(27,28)22-13-24(30)33-23-10-7-17(12-21(22)23)11-16-5-8-20(9-6-16)34(31,32)29-14-18-3-1-2-4-19(18)15-29/h1-10,12-13H,11,14-15H2