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

Systemtic Name: ethyl 2-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]furan-3-carboxylate Openeye Name: ethyl 2-[[4-methyl-3-(1-piperidylsulfonyl)benzoyl]oxymethyl]furan-3-carboxylate CAS Name: 2-[[[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-oxomethoxy]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-methyl-3-piperidin-1-ylsulfonylbenzoyl)oxymethyl]furan-3-carboxylate Traditional Name: 2-[(4-methyl-3-piperidinosulfonyl-benzoyl)oxymethyl]furan-3-carboxylic acid ethyl ester Formula: C21H25NO7S MolecularWeight: 435.4907

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO7S/c1-3-27-21(24)17-9-12-28-18(17)14-29-20(23)16-8-7-15(2)19(13-16)30(25,26)22-10-5-4-6-11-22/h7-9,12-13H,3-6,10-11,14H2,1-2H3