6,7-bis(chloranyl)-5-[(E)-4-methylsulfonylbut-1-enyl]-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name: 6,7-bis(chloranyl)-5-[(E)-4-methylsulfonylbut-1-enyl]-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 6,7-dichloro-5-[(E)-4-methylsulfonylbut-1-enyl]-1,4-dihydroquinoxaline-2,3-dione CAS Name: 6,7-dichloro-5-[(E)-4-methylsulfonylbut-1-enyl]-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 6,7-dichloro-5-[(E)-4-methylsulfonylbut-1-enyl]-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 6,7-dichloro-5-[(E)-4-mesylbut-1-enyl]-1,4-dihydroquinoxaline-2,3-quinone Formula: C13H12Cl2N2O4S MolecularWeight: 363.21638

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC=CC1=C2C(=CC(=C1Cl)Cl)NC(=O)C(=O)N2

Isomeric SMILES

CS(=O)(=O)CC/C=C/C1=C2C(=CC(=C1Cl)Cl)NC(=O)C(=O)N2

InChI

InChI=1S/C13H12Cl2N2O4S/c1-22(20,21)5-3-2-4-7-10(15)8(14)6-9-11(7)17-13(19)12(18)16-9/h2,4,6H,3,5H2,1H3,(H,16,18)(H,17,19)/b4-2+