[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2,5-dimethylfuran-3-carboxylate

Systemtic Name: [(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2,5-dimethylfuran-3-carboxylate Openeye Name: [(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 2,5-dimethylfuran-3-carboxylate CAS Name: 2,5-dimethyl-3-furancarboxylic acid [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] 2,5-dimethylfuran-3-carboxylate Traditional Name: 2,5-dimethylfuran-3-carboxylic acid [(1S)-2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)OC(C)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)O[C@@H](C)C(=O)NC(C)(C)C

InChI

InChI=1S/C14H21NO4/c1-8-7-11(9(2)18-8)13(17)19-10(3)12(16)15-14(4,5)6/h7,10H,1-6H3,(H,15,16)/t10-/m0/s1