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

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 5-(4-ethanoylphenyl)furan-2-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 5-(4-acetylphenyl)furan-2-carboxylate CAS Name: 5-(4-acetylphenyl)-2-furancarboxylic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 5-(4-acetylphenyl)furan-2-carboxylate Traditional Name: 5-(4-acetylphenyl)furan-2-carboxylic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C19H21NO5 MolecularWeight: 343.37374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO5/c1-4-11-20-18(22)13(3)24-19(23)17-10-9-16(25-17)15-7-5-14(6-8-15)12(2)21/h5-10,13H,4,11H2,1-3H3,(H,20,22)/t13-/m0/s1