[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 4-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 4-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] 4-(5-methyl-1,3-dioxo-isoindolin-2-yl)butanoate CAS Name: 4-(5-methyl-1,3-dioxo-2-isoindolyl)butanoic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 4-(5-methyl-1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-(1,3-diketo-5-methyl-isoindolin-2-yl)butyric acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H25N3O6 MolecularWeight: 403.429

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)OCC(=O)NC(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)OCC(=O)NC(=O)NC(C)(C)C

InChI

InChI=1S/C20H25N3O6/c1-12-7-8-13-14(10-12)18(27)23(17(13)26)9-5-6-16(25)29-11-15(24)21-19(28)22-20(2,3)4/h7-8,10H,5-6,9,11H2,1-4H3,(H2,21,22,24,28)