methyl 5-[[4-(2-cyanoethylsulfamoyl)phenyl]carbonyloxymethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[4-(2-cyanoethylsulfamoyl)phenyl]carbonyloxymethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[4-(2-cyanoethylsulfamoyl)benzoyl]oxymethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[4-(2-cyanoethylsulfamoyl)phenyl]-oxomethoxy]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(2-cyanoethylsulfamoyl)benzoyl]oxymethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[4-(2-cyanoethylsulfamoyl)benzoyl]oxymethyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)C(=O)OC

InChI

InChI=1S/C18H18N2O7S/c1-12-16(18(22)25-2)10-14(27-12)11-26-17(21)13-4-6-15(7-5-13)28(23,24)20-9-3-8-19/h4-7,10,20H,3,9,11H2,1-2H3