[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate Openeye Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxo-4-(p-tolyl)butanoate CAS Name: 4-(4-methylphenyl)-4-oxobutanoic acid [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(p-tolyl)butyric acid (3-o-phenetyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NOC(=N2)COC(=O)CCC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1C2=NOC(=N2)COC(=O)CCC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H22N2O5/c1-3-27-19-7-5-4-6-17(19)22-23-20(29-24-22)14-28-21(26)13-12-18(25)16-10-8-15(2)9-11-16/h4-11H,3,12-14H2,1-2H3