8-methyl-7-oxidanyl-4-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 8-methyl-7-oxidanyl-4-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]chromen-2-one Openeye Name: 7-hydroxy-8-methyl-4-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]chromen-2-one CAS Name: 7-hydroxy-8-methyl-4-[[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-8-methyl-4-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]chromen-2-one Traditional Name: 7-hydroxy-8-methyl-4-[[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]methyl]coumarin Formula: C22H21F3N2O5S MolecularWeight: 482.47275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(F)(F)F)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(F)(F)F)O

InChI

InChI=1S/C22H21F3N2O5S/c1-14-19(28)7-6-18-15(12-20(29)32-21(14)18)13-26-8-10-27(11-9-26)33(30,31)17-4-2-16(3-5-17)22(23,24)25/h2-7,12,28H,8-11,13H2,1H3