N-(2,5-dimethylphenyl)-7-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-5-amine

Systemtic Name: N-(2,5-dimethylphenyl)-7-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-5-amine Openeye Name: N-(2,5-dimethylphenyl)-7-morpholino-4-nitro-2,1,3-benzoxadiazol-5-amine CAS Name: N-(2,5-dimethylphenyl)-7-(4-morpholinyl)-4-nitro-2,1,3-benzoxadiazol-5-amine IUPAC Name: N-(2,5-dimethylphenyl)-7-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-5-amine Traditional Name: (2,5-dimethylphenyl)-(7-morpholino-4-nitro-benzofurazan-5-yl)amine Formula: C18H19N5O4 MolecularWeight: 369.37456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC2=C(C3=NON=C3C(=C2)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC2=C(C3=NON=C3C(=C2)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O4/c1-11-3-4-12(2)13(9-11)19-14-10-15(22-5-7-26-8-6-22)16-17(21-27-20-16)18(14)23(24)25/h3-4,9-10,19H,5-8H2,1-2H3