2-tert-butyl-N'-(2-cyanoethanoyl)-1,3-bis(oxidanylidene)isoindole-5-carbohydrazide

Systemtic Name: 2-tert-butyl-N'-(2-cyanoethanoyl)-1,3-bis(oxidanylidene)isoindole-5-carbohydrazide Openeye Name: 2-tert-butyl-N'-(2-cyanoacetyl)-1,3-dioxo-isoindoline-5-carbohydrazide CAS Name: 2-tert-butyl-N'-(2-cyano-1-oxoethyl)-1,3-dioxo-5-isoindolecarbohydrazide IUPAC Name: 2-tert-butyl-N'-(2-cyanoacetyl)-1,3-dioxoisoindole-5-carbohydrazide Traditional Name: 2-tert-butyl-N'-(2-cyanoacetyl)-1,3-diketo-isoindoline-5-carbohydrazide Formula: C16H16N4O4 MolecularWeight: 328.32264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NNC(=O)CC#N

Isomeric SMILES

CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NNC(=O)CC#N

InChI

InChI=1S/C16H16N4O4/c1-16(2,3)20-14(23)10-5-4-9(8-11(10)15(20)24)13(22)19-18-12(21)6-7-17/h4-5,8H,6H2,1-3H3,(H,18,21)(H,19,22)