methyl 5-[(4-acetamidophenyl)sulfonyl-butanoyl-amino]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: methyl 5-[(4-acetamidophenyl)sulfonyl-butanoyl-amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[(4-acetamidophenyl)sulfonyl-butanoyl-amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[(4-acetamidophenyl)sulfonyl-(1-oxobutyl)amino]-2-methyl-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-acetamidophenyl)sulfonyl-butanoylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-acetamidophenyl)sulfonyl-butyryl-amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C23H24N2O7S MolecularWeight: 472.51086

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC2=C(C=C1)OC(=C2C(=O)OC)C)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCCC(=O)N(C1=CC2=C(C=C1)OC(=C2C(=O)OC)C)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C23H24N2O7S/c1-5-6-21(27)25(33(29,30)18-10-7-16(8-11-18)24-15(3)26)17-9-12-20-19(13-17)22(14(2)32-20)23(28)31-4/h7-13H,5-6H2,1-4H3,(H,24,26)