[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] (2S)-2-(2-phenoxyethanoylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] (2S)-2-(2-phenoxyethanoylamino)propanoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate CAS Name: (2S)-2-[(1-oxo-2-phenoxyethyl)amino]propanoic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate Traditional Name: (2S)-2-[(2-phenoxyacetyl)amino]propionic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C(C)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)[C@H](C)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C22H24N2O6/c1-3-20(26)24-17-11-9-16(10-12-17)19(25)13-30-22(28)15(2)23-21(27)14-29-18-7-5-4-6-8-18/h4-12,15H,3,13-14H2,1-2H3,(H,23,27)(H,24,26)/t15-/m0/s1