(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 4-butoxybenzoate

Systemtic Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 4-butoxybenzoate Openeye Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC2=NN=C(O2)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC2=NN=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4/c1-2-3-13-24-17-11-9-16(10-12-17)20(23)25-14-18-21-22-19(26-18)15-7-5-4-6-8-15/h4-12H,2-3,13-14H2,1H3