(5-phenyl-1,3-oxazol-2-yl)methyl 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: (5-phenyl-1,3-oxazol-2-yl)methyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: (5-phenyloxazol-2-yl)methyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (5-phenyl-2-oxazolyl)methyl ester IUPAC Name: (5-phenyl-1,3-oxazol-2-yl)methyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid (5-phenyloxazol-2-yl)methyl ester Formula: C21H19N3O6 MolecularWeight: 409.39206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC3=NC=C(O3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC3=NC=C(O3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O6/c25-21(29-14-20-22-13-19(30-20)15-4-2-1-3-5-15)16-6-7-17(18(12-16)24(26)27)23-8-10-28-11-9-23/h1-7,12-13H,8-11,14H2