[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 5-(4-ethanoylphenyl)furan-2-carboxylate

Systemtic Name: [(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 5-(4-ethanoylphenyl)furan-2-carboxylate Openeye Name: [(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] 5-(4-acetylphenyl)furan-2-carboxylate CAS Name: 5-(4-acetylphenyl)-2-furancarboxylic acid [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] 5-(4-acetylphenyl)furan-2-carboxylate Traditional Name: 5-(4-acetylphenyl)furan-2-carboxylic acid [(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)C1=CC=C(O1)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)OC(=O)C1=CC=C(O1)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C20H23NO5/c1-12(2)11-21-19(23)14(4)25-20(24)18-10-9-17(26-18)16-7-5-15(6-8-16)13(3)22/h5-10,12,14H,11H2,1-4H3,(H,21,23)/t14-/m0/s1