(2R,3R)-3-(4-methylphenyl)sulfonyl-5-nitro-2,3-dihydro-1-benzofuran-2-ol

Systemtic Name: (2R,3R)-3-(4-methylphenyl)sulfonyl-5-nitro-2,3-dihydro-1-benzofuran-2-ol Openeye Name: (2R,3R)-5-nitro-3-(p-tolylsulfonyl)-2,3-dihydrobenzofuran-2-ol CAS Name: (2R,3R)-3-(4-methylphenyl)sulfonyl-5-nitro-2,3-dihydrobenzofuran-2-ol IUPAC Name: (2R,3R)-3-(4-methylphenyl)sulfonyl-5-nitro-2,3-dihydro-1-benzofuran-2-ol Traditional Name: (2R,3R)-5-nitro-3-tosyl-coumaran-2-ol Formula: C15H13NO6S MolecularWeight: 335.33182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2C(OC3=C2C=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@H]2[C@@H](OC3=C2C=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C15H13NO6S/c1-9-2-5-11(6-3-9)23(20,21)14-12-8-10(16(18)19)4-7-13(12)22-15(14)17/h2-8,14-15,17H,1H3/t14-,15-/m1/s1