[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-propan-2-ylbenzoate

Systemtic Name: [3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-propan-2-ylbenzoate Openeye Name: [3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-isopropylbenzoate CAS Name: 4-propan-2-ylbenzoic acid [3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-propan-2-ylbenzoate Traditional Name: 4-isopropylbenzoic acid [3-(2,4-dimethoxyphenyl)-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)C1=CC=C(C=C1)C(=O)OCC2=NC(=NO2)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O5/c1-13(2)14-5-7-15(8-6-14)21(24)27-12-19-22-20(23-28-19)17-10-9-16(25-3)11-18(17)26-4/h5-11,13H,12H2,1-4H3