[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 3-(2-phenylethanoylamino)propanoate

Systemtic Name: [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 3-(2-phenylethanoylamino)propanoate Openeye Name: [5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl 3-[(2-phenylacetyl)amino]propanoate CAS Name: 3-[(1-oxo-2-phenylethyl)amino]propanoic acid [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl ester IUPAC Name: [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 3-[(2-phenylacetyl)amino]propanoate Traditional Name: 3-[(2-phenylacetyl)amino]propionic acid [5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)COC(=O)CCNC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)COC(=O)CCNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4/c1-15-7-9-17(10-8-15)21-23-18(24-28-21)14-27-20(26)11-12-22-19(25)13-16-5-3-2-4-6-16/h2-10H,11-14H2,1H3,(H,22,25)