(2-iodanyl-4-methanoyl-6-methoxy-phenyl) 4-nitrobenzenesulfonate

Systemtic Name: (2-iodanyl-4-methanoyl-6-methoxy-phenyl) 4-nitrobenzenesulfonate Openeye Name: (4-formyl-2-iodo-6-methoxy-phenyl) 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid (4-formyl-2-iodo-6-methoxyphenyl) ester IUPAC Name: (4-formyl-2-iodo-6-methoxyphenyl) 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid (4-formyl-2-iodo-6-methoxy-phenyl) ester Formula: C14H10INO7S MolecularWeight: 463.20117

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)I)OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)I)OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H10INO7S/c1-22-13-7-9(8-17)6-12(15)14(13)23-24(20,21)11-4-2-10(3-5-11)16(18)19/h2-8H,1H3