(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-fluorophenyl)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-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-fluorophenyl)sulfonylisonipecotic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C23H22FNO7S MolecularWeight: 475.486683

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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=CC=C(C=C4)F)O

Isomeric SMILES

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

InChI

InChI=1S/C23H22FNO7S/c1-14-20(26)7-6-19-16(12-21(27)32-22(14)19)13-31-23(28)15-8-10-25(11-9-15)33(29,30)18-4-2-17(24)3-5-18/h2-7,12,15,26H,8-11,13H2,1H3