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

Systemtic Name: [1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [2-(4-ethylphenyl)-1-methyl-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 [1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylphenyl)-1-oxopropan-2-yl] 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-1-methyl-ethyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O4/c1-3-16-9-11-17(12-10-16)21(26)15(2)27-20(25)14-13-19-23-22(24-28-19)18-7-5-4-6-8-18/h4-12,15H,3,13-14H2,1-2H3