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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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