[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]benzoate

Systemtic Name: [2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]benzoate Openeye Name: [2-(benzofuran-2-yl)-2-oxo-ethyl] 4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzoate CAS Name: 4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]benzoic acid [2-(2-benzofuranyl)-2-oxoethyl] ester IUPAC Name: [2-(1-benzofuran-2-yl)-2-oxoethyl] 4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzoic acid [2-(benzofuran-2-yl)-2-keto-ethyl] ester Formula: C25H20BrNO7S MolecularWeight: 558.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C25H20BrNO7S/c1-2-32-22-12-9-18(26)14-24(22)35(30,31)27-19-10-7-16(8-11-19)25(29)33-15-20(28)23-13-17-5-3-4-6-21(17)34-23/h3-14,27H,2,15H2,1H3