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

Systemtic Name: [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(dimethylamino)-3-nitro-benzoate Openeye Name: [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-nitro-benzoic acid [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H18N4O6 MolecularWeight: 398.36942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3OC)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3OC)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O6/c1-22(2)14-9-8-12(10-15(14)23(25)26)19(24)28-11-17-20-18(21-29-17)13-6-4-5-7-16(13)27-3/h4-10H,11H2,1-3H3