(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-methoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-isobutoxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(2-methylpropoxy)benzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxy-3-methoxy-benzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H22N2O5/c1-14(2)12-26-17-10-9-16(11-18(17)25-3)21(24)27-13-19-22-20(23-28-19)15-7-5-4-6-8-15/h4-11,14H,12-13H2,1-3H3