methyl 5-[(4-bromophenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate

Systemtic Name: methyl 5-[(4-bromophenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[(4-bromophenyl)sulfonylamino]-2-(methoxymethyl)benzofuran-3-carboxylate CAS Name: 5-[(4-bromophenyl)sulfonylamino]-2-(methoxymethyl)-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-bromophenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate Traditional Name: 5-(brosylamino)-2-(methoxymethyl)benzofuran-3-carboxylic acid methyl ester Formula: C18H16BrNO6S MolecularWeight: 454.29174

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)Br)C(=O)OC

Isomeric SMILES

COCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C18H16BrNO6S/c1-24-10-16-17(18(21)25-2)14-9-12(5-8-15(14)26-16)20-27(22,23)13-6-3-11(19)4-7-13/h3-9,20H,10H2,1-2H3