6,7-bis(chloranyl)-5-(1-methylsulfonyl-4-oxidanyl-butyl)-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name: 6,7-bis(chloranyl)-5-(1-methylsulfonyl-4-oxidanyl-butyl)-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 6,7-dichloro-5-(4-hydroxy-1-methylsulfonyl-butyl)-1,4-dihydroquinoxaline-2,3-dione CAS Name: 6,7-dichloro-5-(4-hydroxy-1-methylsulfonylbutyl)-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 6,7-dichloro-5-(4-hydroxy-1-methylsulfonylbutyl)-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 6,7-dichloro-5-(4-hydroxy-1-mesyl-butyl)-1,4-dihydroquinoxaline-2,3-quinone Formula: C13H14Cl2N2O5S MolecularWeight: 381.23166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14Cl2N2O5S/c1-23(21,22)8(3-2-4-18)9-10(15)6(14)5-7-11(9)17-13(20)12(19)16-7/h5,8,18H,2-4H2,1H3,(H,16,19)(H,17,20)