[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] (2S)-2-(2-phenoxyethanoylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] (2S)-2-(2-phenoxyethanoylamino)propanoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate CAS Name: (2S)-2-[(1-oxo-2-phenoxyethyl)amino]propanoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate Traditional Name: (2S)-2-[(2-phenoxyacetyl)amino]propionic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C(C)NC(=O)COC2=CC=CC=C2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)[C@H](C)NC(=O)COC2=CC=CC=C2)C)C

InChI

InChI=1S/C22H25NO5/c1-14-10-16(3)19(11-15(14)2)20(24)12-28-22(26)17(4)23-21(25)13-27-18-8-6-5-7-9-18/h5-11,17H,12-13H2,1-4H3,(H,23,25)/t17-/m0/s1