methyl 5-[(4-bromophenyl)sulfonylamino]-2-tert-butyl-6-methyl-1-benzofuran-3-carboxylate

Systemtic Name: methyl 5-[(4-bromophenyl)sulfonylamino]-2-tert-butyl-6-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[(4-bromophenyl)sulfonylamino]-2-tert-butyl-6-methyl-benzofuran-3-carboxylate CAS Name: 5-[(4-bromophenyl)sulfonylamino]-2-tert-butyl-6-methyl-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-bromophenyl)sulfonylamino]-2-tert-butyl-6-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-(brosylamino)-2-tert-butyl-6-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C21H22BrNO5S MolecularWeight: 480.37208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C2C(=O)OC)C(C)(C)C)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C2C(=O)OC)C(C)(C)C)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrNO5S/c1-12-10-17-15(18(20(24)27-5)19(28-17)21(2,3)4)11-16(12)23-29(25,26)14-8-6-13(22)7-9-14/h6-11,23H,1-5H3