3-methyl-5-(phenethylsulfamoyl)-1-benzofuran-2-carboxylate

Systemtic Name: 3-methyl-5-(phenethylsulfamoyl)-1-benzofuran-2-carboxylate Openeye Name: 3-methyl-5-(phenethylsulfamoyl)benzofuran-2-carboxylate CAS Name: 3-methyl-5-(phenethylsulfamoyl)-2-benzofurancarboxylate IUPAC Name: 3-methyl-5-(phenethylsulfamoyl)-1-benzofuran-2-carboxylate Traditional Name: 3-methyl-5-(phenethylsulfamoyl)coumarilate Formula: C18H16NO5S- MolecularWeight: 358.38834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C18H17NO5S/c1-12-15-11-14(7-8-16(15)24-17(12)18(20)21)25(22,23)19-10-9-13-5-3-2-4-6-13/h2-8,11,19H,9-10H2,1H3,(H,20,21)/p-1