(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-4,5-dimethoxybenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxybenzoate Traditional Name: 4,5-dimethoxy-2-(pivaloylamino)benzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C23H25N3O6 MolecularWeight: 439.4611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)OC)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C23H25N3O6/c1-23(2,3)22(28)24-16-12-18(30-5)17(29-4)11-15(16)21(27)31-13-19-25-20(26-32-19)14-9-7-6-8-10-14/h6-12H,13H2,1-5H3,(H,24,28)