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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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