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

Systemtic Name: 5-[(4-bromophenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: 5-[(4-bromophenyl)sulfonylamino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[(4-bromophenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylate IUPAC Name: 5-[(4-bromophenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-(brosylamino)-2-methyl-benzofuran-3-carboxylate Formula: C16H11BrNO5S- MolecularWeight: 409.23124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)Br)C(=O)[O-]

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)Br)C(=O)[O-]

InChI

InChI=1S/C16H12BrNO5S/c1-9-15(16(19)20)13-8-11(4-7-14(13)23-9)18-24(21,22)12-5-2-10(17)3-6-12/h2-8,18H,1H3,(H,19,20)/p-1