(3-iodanylphenyl) 2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-sulfonate

Systemtic Name: (3-iodanylphenyl) 2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-sulfonate Openeye Name: (3-iodophenyl) 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonate CAS Name: 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonic acid (3-iodophenyl) ester IUPAC Name: (3-iodophenyl) 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonate Traditional Name: 2,3-diketo-1,4-dihydroquinoxaline-6-sulfonic acid (3-iodophenyl) ester Formula: C14H9IN2O5S MolecularWeight: 444.20113

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C(=O)N3

Isomeric SMILES

C1=CC(=CC(=C1)I)OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C(=O)N3

InChI

InChI=1S/C14H9IN2O5S/c15-8-2-1-3-9(6-8)22-23(20,21)10-4-5-11-12(7-10)17-14(19)13(18)16-11/h1-7H,(H,16,18)(H,17,19)