2-[2,6-bis(oxidanylidene)piperidin-3-yl]-4-[(4-methylsulfonylphenyl)methoxy]isoindole-1,3-dione

Systemtic Name: 2-[2,6-bis(oxidanylidene)piperidin-3-yl]-4-[(4-methylsulfonylphenyl)methoxy]isoindole-1,3-dione Openeye Name: 2-(2,6-dioxo-3-piperidyl)-4-[(4-methylsulfonylphenyl)methoxy]isoindoline-1,3-dione CAS Name: 2-(2,6-dioxo-3-piperidinyl)-4-[(4-methylsulfonylphenyl)methoxy]isoindole-1,3-dione IUPAC Name: 2-(2,6-dioxopiperidin-3-yl)-4-[(4-methylsulfonylphenyl)methoxy]isoindole-1,3-dione Traditional Name: 2-(2,6-diketo-3-piperidyl)-4-(4-mesylbenzyl)oxy-isoindoline-1,3-quinone Formula: C21H18N2O7S MolecularWeight: 442.44182

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)COC2=CC=CC3=C2C(=O)N(C3=O)C4CCC(=O)NC4=O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)COC2=CC=CC3=C2C(=O)N(C3=O)C4CCC(=O)NC4=O

InChI

InChI=1S/C21H18N2O7S/c1-31(28,29)13-7-5-12(6-8-13)11-30-16-4-2-3-14-18(16)21(27)23(20(14)26)15-9-10-17(24)22-19(15)25/h2-8,15H,9-11H2,1H3,(H,22,24,25)