(4-acetamidophenyl) 3-nitrobenzenesulfonate

Systemtic Name: (4-acetamidophenyl) 3-nitrobenzenesulfonate Openeye Name: (4-acetamidophenyl) 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid (4-acetamidophenyl) ester Formula: C14H12N2O6S MolecularWeight: 336.31988

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