(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 1-[2,4-bis(fluoranyl)phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 1-[2,4-bis(fluoranyl)phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 1-(2,4-difluorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,4-difluorophenyl)sulfonyl-4-piperidinecarboxylic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 1-(2,4-difluorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2,4-difluorophenyl)sulfonylisonipecotic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C23H21F2NO7S MolecularWeight: 493.477146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)F)F)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)F)F)O

InChI

InChI=1S/C23H21F2NO7S/c1-13-19(27)4-3-17-15(10-21(28)33-22(13)17)12-32-23(29)14-6-8-26(9-7-14)34(30,31)20-5-2-16(24)11-18(20)25/h2-5,10-11,14,27H,6-9,12H2,1H3