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

Systemtic Name: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [2-(4-ethylphenyl)-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-(4-ethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylphenyl)-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-(4-ethylphenyl)-2-keto-ethyl] ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O4/c1-2-15-8-10-16(11-9-15)18(24)14-26-20(25)13-12-19-22-21(23-27-19)17-6-4-3-5-7-17/h3-11H,2,12-14H2,1H3