[4-(1,3,4-oxadiazol-2-yl)phenyl] 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester IUPAC Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester Formula: C19H16N4O6 MolecularWeight: 396.35354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=NN=CO4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=NN=CO4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O6/c24-19(29-15-4-1-13(2-5-15)18-21-20-12-28-18)14-3-6-16(17(11-14)23(25)26)22-7-9-27-10-8-22/h1-6,11-12H,7-10H2