methyl 5-[3-(4-piperidin-1-ylsulfonylphenyl)propanoyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[3-(4-piperidin-1-ylsulfonylphenyl)propanoyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[3-[4-(1-piperidylsulfonyl)phenyl]propanoyloxymethyl]furan-2-carboxylate CAS Name: 5-[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[3-(4-piperidin-1-ylsulfonylphenyl)propanoyloxymethyl]furan-2-carboxylate Traditional Name: 5-[3-(4-piperidinosulfonylphenyl)propanoyloxymethyl]furan-2-carboxylic acid methyl ester Formula: C21H25NO7S MolecularWeight: 435.4907

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(O1)COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25NO7S/c1-27-21(24)19-11-8-17(29-19)15-28-20(23)12-7-16-5-9-18(10-6-16)30(25,26)22-13-3-2-4-14-22/h5-6,8-11H,2-4,7,12-15H2,1H3