2-chloranyl-5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)sulfamoyl]benzoic acid

Systemtic Name: 2-chloranyl-5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)sulfamoyl]benzoic acid Openeye Name: 2-chloro-5-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)sulfamoyl]benzoic acid CAS Name: 2-chloro-5-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)sulfamoyl]benzoic acid IUPAC Name: 2-chloro-5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)sulfamoyl]benzoic acid Traditional Name: 2-chloro-5-[(5-ethoxy-2-methyl-coumaran-6-yl)sulfamoyl]benzoic acid Formula: C18H18ClNO6S MolecularWeight: 411.85662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClNO6S/c1-3-25-17-7-11-6-10(2)26-16(11)9-15(17)20-27(23,24)12-4-5-14(19)13(8-12)18(21)22/h4-5,7-10,20H,3,6H2,1-2H3,(H,21,22)