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

Systemtic Name: [2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [2-(3-ethylanilino)-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-(3-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylanilino)-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-(3-ethylanilino)-2-keto-ethyl] ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)COC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)COC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4/c1-2-15-7-6-10-17(13-15)22-18(25)14-27-20(26)12-11-19-23-21(24-28-19)16-8-4-3-5-9-16/h3-10,13H,2,11-12,14H2,1H3,(H,22,25)