ethyl 5-(butylsulfonylamino)-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-(butylsulfonylamino)-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-(butylsulfonylamino)-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-(butylsulfonylamino)-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(butylsulfonylamino)-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-(butylsulfonylamino)-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CC2=C(C=C1)OC(=C2C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCCCS(=O)(=O)NC1=CC2=C(C=C1)OC(=C2C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO5S/c1-3-5-13-28(24,25)22-16-11-12-18-17(14-16)19(21(23)26-4-2)20(27-18)15-9-7-6-8-10-15/h6-12,14,22H,3-5,13H2,1-2H3