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

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 5-(phenoxymethyl)furan-2-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 5-(phenoxymethyl)furan-2-carboxylate CAS Name: 5-(phenoxymethyl)-2-furancarboxylic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 5-(phenoxymethyl)furan-2-carboxylate Traditional Name: 5-(phenoxymethyl)furan-2-carboxylic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC=C(O1)COC2=CC=CC=C2

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=CC=C(O1)COC2=CC=CC=C2

InChI

InChI=1S/C18H21NO5/c1-3-11-19-17(20)13(2)23-18(21)16-10-9-15(24-16)12-22-14-7-5-4-6-8-14/h4-10,13H,3,11-12H2,1-2H3,(H,19,20)/t13-/m0/s1