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

Systemtic Name: (3-ethanoylphenyl) 2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-sulfonate Openeye Name: (3-acetylphenyl) 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonate CAS Name: 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonate Traditional Name: 2,3-diketo-1,4-dihydroquinoxaline-6-sulfonic acid (3-acetylphenyl) ester Formula: C16H12N2O6S MolecularWeight: 360.34128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O6S/c1-9(19)10-3-2-4-11(7-10)24-25(22,23)12-5-6-13-14(8-12)18-16(21)15(20)17-13/h2-8H,1H3,(H,17,20)(H,18,21)