methyl 2-tert-butyl-5-[(4-methylphenyl)sulfonylamino]benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: methyl 2-tert-butyl-5-[(4-methylphenyl)sulfonylamino]benzo[g][1]benzofuran-3-carboxylate Openeye Name: methyl 2-tert-butyl-5-(p-tolylsulfonylamino)benzo[g]benzofuran-3-carboxylate CAS Name: 2-tert-butyl-5-[(4-methylphenyl)sulfonylamino]-3-benzo[g]benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-tert-butyl-5-[(4-methylphenyl)sulfonylamino]benzo[g][1]benzofuran-3-carboxylate Traditional Name: 2-tert-butyl-5-(tosylamino)benzo[g]benzofuran-3-carboxylic acid methyl ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C4=CC=CC=C42)OC(=C3C(=O)OC)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C4=CC=CC=C42)OC(=C3C(=O)OC)C(C)(C)C

InChI

InChI=1S/C25H25NO5S/c1-15-10-12-16(13-11-15)32(28,29)26-20-14-19-21(24(27)30-5)23(25(2,3)4)31-22(19)18-9-7-6-8-17(18)20/h6-14,26H,1-5H3