6-[[4-(4-oxidanylpiperidin-1-yl)sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one

Systemtic Name: 6-[[4-(4-oxidanylpiperidin-1-yl)sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one Openeye Name: 6-[[4-[(4-hydroxy-1-piperidyl)sulfonyl]phenyl]methyl]-4-(trifluoromethyl)chromen-2-one CAS Name: 6-[[4-[(4-hydroxy-1-piperidinyl)sulfonyl]phenyl]methyl]-4-(trifluoromethyl)-1-benzopyran-2-one IUPAC Name: 6-[[4-(4-hydroxypiperidin-1-yl)sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one Traditional Name: 6-[4-(4-hydroxypiperidino)sulfonylbenzyl]-4-(trifluoromethyl)coumarin Formula: C22H20F3NO5S MolecularWeight: 467.45811

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)S(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)OC(=O)C=C4C(F)(F)F

Isomeric SMILES

C1CN(CCC1O)S(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)OC(=O)C=C4C(F)(F)F

InChI

InChI=1S/C22H20F3NO5S/c23-22(24,25)19-13-21(28)31-20-6-3-15(12-18(19)20)11-14-1-4-17(5-2-14)32(29,30)26-9-7-16(27)8-10-26/h1-6,12-13,16,27H,7-11H2