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

Systemtic Name: 8-methoxy-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 8-methoxy-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]chromen-2-one CAS Name: 8-methoxy-3-[oxo-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 8-methoxy-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]chromen-2-one Traditional Name: 8-methoxy-3-[4-[3-(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(=C4)C(F)(F)F

Isomeric SMILES

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

InChI

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