ethyl 5-[(4-bromophenyl)sulfonylamino]-2-propyl-benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(4-bromophenyl)sulfonylamino]-2-propyl-benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-bromophenyl)sulfonylamino]-2-propyl-benzo[g]benzofuran-3-carboxylate CAS Name: 5-[(4-bromophenyl)sulfonylamino]-2-propyl-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-bromophenyl)sulfonylamino]-2-propylbenzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-(brosylamino)-2-propyl-benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C24H22BrNO5S MolecularWeight: 516.40418

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=C(C=C4)Br)C(=O)OCC

Isomeric SMILES

CCCC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=C(C=C4)Br)C(=O)OCC

InChI

InChI=1S/C24H22BrNO5S/c1-3-7-21-22(24(27)30-4-2)19-14-20(17-8-5-6-9-18(17)23(19)31-21)26-32(28,29)16-12-10-15(25)11-13-16/h5-6,8-14,26H,3-4,7H2,1-2H3