methyl 5-[(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]-3-methyl-furan-2-carboxylate

Systemtic Name: methyl 5-[(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]-3-methyl-furan-2-carboxylate Openeye Name: methyl 5-[[4-fluoro-3-(1-piperidylsulfonyl)benzoyl]oxymethyl]-3-methyl-furan-2-carboxylate CAS Name: 5-[[[4-fluoro-3-(1-piperidinylsulfonyl)phenyl]-oxomethoxy]methyl]-3-methyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-fluoro-3-piperidin-1-ylsulfonylbenzoyl)oxymethyl]-3-methylfuran-2-carboxylate Traditional Name: 5-[(4-fluoro-3-piperidinosulfonyl-benzoyl)oxymethyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C20H22FNO7S MolecularWeight: 439.454583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3)C(=O)OC

InChI

InChI=1S/C20H22FNO7S/c1-13-10-15(29-18(13)20(24)27-2)12-28-19(23)14-6-7-16(21)17(11-14)30(25,26)22-8-4-3-5-9-22/h6-7,10-11H,3-5,8-9,12H2,1-2H3