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

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3,4,5-triethoxybenzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O6/c1-4-26-17-12-16(13-18(27-5-2)20(17)28-6-3)22(25)29-14-19-23-21(24-30-19)15-10-8-7-9-11-15/h7-13H,4-6,14H2,1-3H3