[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-methyl-4-nitro-benzoate

Systemtic Name: [3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-methyl-4-nitro-benzoate Openeye Name: [3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic 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 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H17N3O7 MolecularWeight: 399.35418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC2=NC(=NO2)C3=C(C=C(C=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCC2=NC(=NO2)C3=C(C=C(C=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O7/c1-11-8-12(4-7-15(11)22(24)25)19(23)28-10-17-20-18(21-29-17)14-6-5-13(26-2)9-16(14)27-3/h4-9H,10H2,1-3H3