(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl 4-tert-butylbenzoate

Systemtic Name: (3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl 4-tert-butylbenzoate Openeye Name: [3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]methyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H19N3O3 MolecularWeight: 337.37246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CN=CC=C3

InChI

InChI=1S/C19H19N3O3/c1-19(2,3)15-8-6-13(7-9-15)18(23)24-12-16-21-17(22-25-16)14-5-4-10-20-11-14/h4-11H,12H2,1-3H3