ethyl 5-[(4-chloranyl-3-methyl-phenyl)sulfonylamino]-2-propyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(4-chloranyl-3-methyl-phenyl)sulfonylamino]-2-propyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-chloro-3-methyl-phenyl)sulfonylamino]-2-propyl-benzofuran-3-carboxylate CAS Name: 5-[(4-chloro-3-methylphenyl)sulfonylamino]-2-propyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-chloro-3-methylphenyl)sulfonylamino]-2-propyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-chloro-3-methyl-phenyl)sulfonylamino]-2-propyl-benzofuran-3-carboxylic acid ethyl ester Formula: C21H22ClNO5S MolecularWeight: 435.92108

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C)C(=O)OCC

Isomeric SMILES

CCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C)C(=O)OCC

InChI

InChI=1S/C21H22ClNO5S/c1-4-6-19-20(21(24)27-5-2)16-12-14(7-10-18(16)28-19)23-29(25,26)15-8-9-17(22)13(3)11-15/h7-12,23H,4-6H2,1-3H3