methyl 5-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[2-chloro-5-(1-piperidylsulfonyl)benzoyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-chloro-5-piperidin-1-ylsulfonylbenzoyl)oxymethyl]furan-2-carboxylate Traditional Name: 5-[(2-chloro-5-piperidinosulfonyl-benzoyl)oxymethyl]furan-2-carboxylic acid methyl ester Formula: C19H20ClNO7S MolecularWeight: 441.8826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClNO7S/c1-26-19(23)17-8-5-13(28-17)12-27-18(22)15-11-14(6-7-16(15)20)29(24,25)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10,12H2,1H3