[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate CAS Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propionic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)COC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)COC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

InChI

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