(4-acetamidophenyl) 2-nitrobenzenesulfonate

Systemtic Name: (4-acetamidophenyl) 2-nitrobenzenesulfonate Openeye Name: (4-acetamidophenyl) 2-nitrobenzenesulfonate CAS Name: 2-nitrobenzenesulfonic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-nitrobenzenesulfonate Traditional Name: 2-nitrobenzenesulfonic acid (4-acetamidophenyl) ester Formula: C14H12N2O6S MolecularWeight: 336.31988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O6S/c1-10(17)15-11-6-8-12(9-7-11)22-23(20,21)14-5-3-2-4-13(14)16(18)19/h2-9H,1H3,(H,15,17)