8-methoxy-3-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 8-methoxy-3-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 8-methoxy-3-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]chromen-2-one CAS Name: 8-methoxy-3-[oxo-[4-[2-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 8-methoxy-3-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]chromen-2-one Traditional Name: 8-methoxy-3-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]coumarin Formula: C22H19F3N2O6S MolecularWeight: 496.45627

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H19F3N2O6S/c1-32-17-7-4-5-14-13-15(21(29)33-19(14)17)20(28)26-9-11-27(12-10-26)34(30,31)18-8-3-2-6-16(18)22(23,24)25/h2-8,13H,9-12H2,1H3