[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-acetyloxyphenyl)benzoate

Systemtic Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-acetyloxyphenyl)benzoate Openeye Name: (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl 4-(4-acetoxyphenyl)benzoate CAS Name: 4-(4-acetyloxyphenyl)benzoic acid [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-acetyloxyphenyl)benzoate Traditional Name: 4-(4-acetoxyphenyl)benzoic acid (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C

InChI

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