[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3,4-diethoxybenzoate

Systemtic Name: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3,4-diethoxybenzoate Openeye Name: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3,4-diethoxybenzoate CAS Name: 3,4-diethoxybenzoic acid [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3,4-diethoxybenzoate Traditional Name: 3,4-diethoxybenzoic acid [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)OC)OCC

InChI

InChI=1S/C21H22N2O6/c1-4-26-17-10-9-15(12-18(17)27-5-2)21(24)28-13-19-22-20(23-29-19)14-7-6-8-16(11-14)25-3/h6-12H,4-5,13H2,1-3H3