dimethyl 2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]sulfamoyl]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]sulfamoyl]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]sulfamoyl]benzene-1,4-dicarboxylate CAS Name: 2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]sulfamoyl]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]sulfamoyl]benzene-1,4-dicarboxylate Traditional Name: 2-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]sulfamoyl]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H23NO8S MolecularWeight: 449.47422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H23NO8S/c1-5-29-18-9-14-8-12(2)30-17(14)11-16(18)22-31(25,26)19-10-13(20(23)27-3)6-7-15(19)21(24)28-4/h6-7,9-12,22H,5,8H2,1-4H3/t12-/m0/s1