(3-nitro-1-benzofuran-5-yl) 4-methoxybenzenesulfonate

Systemtic Name: (3-nitro-1-benzofuran-5-yl) 4-methoxybenzenesulfonate Openeye Name: (3-nitrobenzofuran-5-yl) 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid (3-nitro-5-benzofuranyl) ester IUPAC Name: (3-nitro-1-benzofuran-5-yl) 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid (3-nitrobenzofuran-5-yl) ester Formula: C15H11NO7S MolecularWeight: 349.31534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)OC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)OC=C3[N+](=O)[O-]

InChI

InChI=1S/C15H11NO7S/c1-21-10-2-5-12(6-3-10)24(19,20)23-11-4-7-15-13(8-11)14(9-22-15)16(17)18/h2-9H,1H3