(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl 2-chloranyl-5-(dimethylsulfamoyl)benzoate

Systemtic Name: (5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl 2-chloranyl-5-(dimethylsulfamoyl)benzoate Openeye Name: (5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl 2-chloro-5-(dimethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid (5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl ester IUPAC Name: (5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl 2-chloro-5-(dimethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid (5-ethoxy-2-methyl-coumaran-6-yl)methyl ester Formula: C21H24ClNO6S MolecularWeight: 453.93636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N(C)C)Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N(C)C)Cl

InChI

InChI=1S/C21H24ClNO6S/c1-5-27-19-9-14-8-13(2)29-20(14)10-15(19)12-28-21(24)17-11-16(6-7-18(17)22)30(25,26)23(3)4/h6-7,9-11,13H,5,8,12H2,1-4H3