methyl 3-[[3-(furan-2-ylmethylsulfamoyl)phenyl]sulfamoyl]-4-methyl-benzoate

Systemtic Name: methyl 3-[[3-(furan-2-ylmethylsulfamoyl)phenyl]sulfamoyl]-4-methyl-benzoate Openeye Name: methyl 3-[[3-(2-furylmethylsulfamoyl)phenyl]sulfamoyl]-4-methyl-benzoate CAS Name: 3-[[3-(2-furanylmethylsulfamoyl)phenyl]sulfamoyl]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[3-(furan-2-ylmethylsulfamoyl)phenyl]sulfamoyl]-4-methylbenzoate Traditional Name: 3-[[3-(2-furfurylsulfamoyl)phenyl]sulfamoyl]-4-methyl-benzoic acid methyl ester Formula: C20H20N2O7S2 MolecularWeight: 464.512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H20N2O7S2/c1-14-8-9-15(20(23)28-2)11-19(14)31(26,27)22-16-5-3-7-18(12-16)30(24,25)21-13-17-6-4-10-29-17/h3-12,21-22H,13H2,1-2H3