[(2S)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-phenylfuran-2-carboxylate

Systemtic Name: [(2S)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-phenylfuran-2-carboxylate Openeye Name: [(1S)-2-(tert-butylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-phenylfuran-2-carboxylate CAS Name: 3-phenyl-2-furancarboxylic acid [(2S)-1-[[(tert-butylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] 3-phenylfuran-2-carboxylate Traditional Name: 3-phenylfuran-2-carboxylic acid [(1S)-2-(tert-butylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H22N2O5 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)OC(=O)C1=C(C=CO1)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)(C)C)OC(=O)C1=C(C=CO1)C2=CC=CC=C2

InChI

InChI=1S/C19H22N2O5/c1-12(16(22)20-18(24)21-19(2,3)4)26-17(23)15-14(10-11-25-15)13-8-6-5-7-9-13/h5-12H,1-4H3,(H2,20,21,22,24)/t12-/m0/s1