[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxylate

Systemtic Name: [1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxylate Openeye Name: [2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxylic acid [1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-1-oxopropan-2-yl] 1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(tetrahydrofurfuryl)isoindoline-5-carboxylic acid [2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3CCCO3

Isomeric SMILES

CC(C(=O)NC(C)(C)C)OC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3CCCO3

InChI

InChI=1S/C21H26N2O6/c1-12(17(24)22-21(2,3)4)29-20(27)13-7-8-15-16(10-13)19(26)23(18(15)25)11-14-6-5-9-28-14/h7-8,10,12,14H,5-6,9,11H2,1-4H3,(H,22,24)