2-[2,6-bis(oxidanylidene)piperidin-3-yl]-5-(3,3-dimethylbut-1-ynyl)isoindole-1,3-dione

Systemtic Name: 2-[2,6-bis(oxidanylidene)piperidin-3-yl]-5-(3,3-dimethylbut-1-ynyl)isoindole-1,3-dione Openeye Name: 5-(3,3-dimethylbut-1-ynyl)-2-(2,6-dioxo-3-piperidyl)isoindoline-1,3-dione CAS Name: 5-(3,3-dimethylbut-1-ynyl)-2-(2,6-dioxo-3-piperidinyl)isoindole-1,3-dione IUPAC Name: 5-(3,3-dimethylbut-1-ynyl)-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione Traditional Name: 2-(2,6-diketo-3-piperidyl)-5-(3,3-dimethylbut-1-ynyl)isoindoline-1,3-quinone Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC1=CC2=C(C=C1)C(=O)N(C2=O)C3CCC(=O)NC3=O

Isomeric SMILES

CC(C)(C)C#CC1=CC2=C(C=C1)C(=O)N(C2=O)C3CCC(=O)NC3=O

InChI

InChI=1S/C19H18N2O4/c1-19(2,3)9-8-11-4-5-12-13(10-11)18(25)21(17(12)24)14-6-7-15(22)20-16(14)23/h4-5,10,14H,6-7H2,1-3H3,(H,20,22,23)