[5-(2,5-dimethylfuran-3-yl)-1,3,4-oxadiazol-2-yl]methyl 4-ethylbenzoate

Systemtic Name: [5-(2,5-dimethylfuran-3-yl)-1,3,4-oxadiazol-2-yl]methyl 4-ethylbenzoate Openeye Name: [5-(2,5-dimethyl-3-furyl)-1,3,4-oxadiazol-2-yl]methyl 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [5-(2,5-dimethyl-3-furanyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(2,5-dimethylfuran-3-yl)-1,3,4-oxadiazol-2-yl]methyl 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [5-(2,5-dimethyl-3-furyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OCC2=NN=C(O2)C3=C(OC(=C3)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OCC2=NN=C(O2)C3=C(OC(=C3)C)C

InChI

InChI=1S/C18H18N2O4/c1-4-13-5-7-14(8-6-13)18(21)22-10-16-19-20-17(24-16)15-9-11(2)23-12(15)3/h5-9H,4,10H2,1-3H3