methyl 4-[2-[(2S)-2-(2-phenoxyethanoylamino)propanoyl]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(2S)-2-(2-phenoxyethanoylamino)propanoyl]oxyethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(2S)-2-[(2-phenoxyacetyl)amino]propanoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(2S)-1-oxo-2-[(1-oxo-2-phenoxyethyl)amino]propoxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(2S)-2-[(2-phenoxyacetyl)amino]propanoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(2S)-2-[(2-phenoxyacetyl)amino]propanoyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C21H22N2O7 MolecularWeight: 414.40858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C21H22N2O7/c1-14(22-18(24)12-29-17-6-4-3-5-7-17)20(26)30-13-19(25)23-16-10-8-15(9-11-16)21(27)28-2/h3-11,14H,12-13H2,1-2H3,(H,22,24)(H,23,25)/t14-/m0/s1