[(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-2-phenylazanyl-furan-3-carboxylate

Systemtic Name: [(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-2-phenylazanyl-furan-3-carboxylate Openeye Name: [(1S)-2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 2-anilino-4-oxo-furan-3-carboxylate CAS Name: 2-anilino-4-oxo-3-furancarboxylic acid [(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] 2-anilino-4-oxofuran-3-carboxylate Traditional Name: 2-anilino-4-keto-furan-3-carboxylic acid [(1S)-2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=C(OCC2=O)NC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=C(OCC2=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H21NO5/c1-3-15-9-11-16(12-10-15)20(25)14(2)28-22(26)19-18(24)13-27-21(19)23-17-7-5-4-6-8-17/h4-12,14,23H,3,13H2,1-2H3/t14-/m0/s1