(2,5-dimethylphenyl)methyl 4-(furan-2-ylmethylsulfamoyl)benzoate

Systemtic Name: (2,5-dimethylphenyl)methyl 4-(furan-2-ylmethylsulfamoyl)benzoate Openeye Name: (2,5-dimethylphenyl)methyl 4-(2-furylmethylsulfamoyl)benzoate CAS Name: 4-(2-furanylmethylsulfamoyl)benzoic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 4-(furan-2-ylmethylsulfamoyl)benzoate Traditional Name: 4-(2-furfurylsulfamoyl)benzoic acid (2,5-dimethylbenzyl) ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO5S/c1-15-5-6-16(2)18(12-15)14-27-21(23)17-7-9-20(10-8-17)28(24,25)22-13-19-4-3-11-26-19/h3-12,22H,13-14H2,1-2H3