(2-methoxy-5-nitro-phenyl) 2,3-dihydro-1-benzofuran-5-sulfonate

Systemtic Name: (2-methoxy-5-nitro-phenyl) 2,3-dihydro-1-benzofuran-5-sulfonate Openeye Name: (2-methoxy-5-nitro-phenyl) 2,3-dihydrobenzofuran-5-sulfonate CAS Name: 2,3-dihydrobenzofuran-5-sulfonic acid (2-methoxy-5-nitrophenyl) ester IUPAC Name: (2-methoxy-5-nitrophenyl) 2,3-dihydro-1-benzofuran-5-sulfonate Traditional Name: coumaran-5-sulfonic acid (2-methoxy-5-nitro-phenyl) ester Formula: C15H13NO7S MolecularWeight: 351.33122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OS(=O)(=O)C2=CC3=C(C=C2)OCC3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OS(=O)(=O)C2=CC3=C(C=C2)OCC3

InChI

InChI=1S/C15H13NO7S/c1-21-14-4-2-11(16(17)18)9-15(14)23-24(19,20)12-3-5-13-10(8-12)6-7-22-13/h2-5,8-9H,6-7H2,1H3