methyl 2-methyl-5-[(4-methylphenyl)sulfonyl-phenoxycarbonyl-amino]-1-benzofuran-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[(4-methylphenyl)sulfonyl-phenoxycarbonyl-amino]-1-benzofuran-3-carboxylate Openeye Name: methyl 2-methyl-5-[phenoxycarbonyl(p-tolylsulfonyl)amino]benzofuran-3-carboxylate CAS Name: 2-methyl-5-[(4-methylphenyl)sulfonyl-[oxo(phenoxy)methyl]amino]-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(4-methylphenyl)sulfonyl-phenoxycarbonylamino]-1-benzofuran-3-carboxylate Traditional Name: 5-[carbophenoxy(tosyl)amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C25H21NO7S MolecularWeight: 479.50174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C25H21NO7S/c1-16-9-12-20(13-10-16)34(29,30)26(25(28)33-19-7-5-4-6-8-19)18-11-14-22-21(15-18)23(17(2)32-22)24(27)31-3/h4-15H,1-3H3