(4-ethanoyl-2-methoxy-phenyl) 2-nitrobenzenesulfonate

Systemtic Name: (4-ethanoyl-2-methoxy-phenyl) 2-nitrobenzenesulfonate Openeye Name: (4-acetyl-2-methoxy-phenyl) 2-nitrobenzenesulfonate CAS Name: 2-nitrobenzenesulfonic acid (4-acetyl-2-methoxyphenyl) ester IUPAC Name: (4-acetyl-2-methoxyphenyl) 2-nitrobenzenesulfonate Traditional Name: 2-nitrobenzenesulfonic acid (4-acetyl-2-methoxy-phenyl) ester Formula: C15H13NO7S MolecularWeight: 351.33122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13NO7S/c1-10(17)11-7-8-13(14(9-11)22-2)23-24(20,21)15-6-4-3-5-12(15)16(18)19/h3-9H,1-2H3