5,6-bis(chloranyl)-2-(4-methylsulfonyl-1-morpholin-4-yl-1-oxidanylidene-butan-2-yl)isoindole-1,3-dione

Systemtic Name: 5,6-bis(chloranyl)-2-(4-methylsulfonyl-1-morpholin-4-yl-1-oxidanylidene-butan-2-yl)isoindole-1,3-dione Openeye Name: 5,6-dichloro-2-[3-methylsulfonyl-1-(morpholine-4-carbonyl)propyl]isoindoline-1,3-dione CAS Name: 5,6-dichloro-2-[4-methylsulfonyl-1-(4-morpholinyl)-1-oxobutan-2-yl]isoindole-1,3-dione IUPAC Name: 5,6-dichloro-2-(4-methylsulfonyl-1-morpholin-4-yl-1-oxobutan-2-yl)isoindole-1,3-dione Traditional Name: 5,6-dichloro-2-[3-mesyl-1-(morpholine-4-carbonyl)propyl]isoindoline-1,3-quinone Formula: C17H18Cl2N2O6S MolecularWeight: 449.30562

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)N1CCOCC1)N2C(=O)C3=CC(=C(C=C3C2=O)Cl)Cl

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)N1CCOCC1)N2C(=O)C3=CC(=C(C=C3C2=O)Cl)Cl

InChI

InChI=1S/C17H18Cl2N2O6S/c1-28(25,26)7-2-14(17(24)20-3-5-27-6-4-20)21-15(22)10-8-12(18)13(19)9-11(10)16(21)23/h8-9,14H,2-7H2,1H3