1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoate Openeye Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 4-(2,5-dimethylphenyl)-4-oxo-butanoate CAS Name: 4-(2,5-dimethylphenyl)-4-oxobutanoic acid 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl ester IUPAC Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 4-(2,5-dimethylphenyl)-4-oxobutanoate Traditional Name: 4-(2,5-dimethylphenyl)-4-keto-butyric acid 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)OC(C)C2=NN=C(O2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)OC(C)C2=NN=C(O2)C3=CC=CC=C3

InChI

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