4-nitro-N-(3-nitrophenyl)-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-amine

Systemtic Name: 4-nitro-N-(3-nitrophenyl)-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-amine Openeye Name: 4-nitro-N-(3-nitrophenyl)-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-amine CAS Name: 4-nitro-N-(3-nitrophenyl)-5-(1-pyrrolidinyl)-2,1,3-benzoxadiazol-7-amine IUPAC Name: 4-nitro-N-(3-nitrophenyl)-5-pyrrolidin-1-yl-2,1,3-benzoxadiazol-7-amine Traditional Name: (3-nitrophenyl)-(7-nitro-6-pyrrolidino-benzofurazan-4-yl)amine Formula: C16H14N6O5 MolecularWeight: 370.31956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C3=NON=C3C(=C2)NC4=CC(=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C3=NON=C3C(=C2)NC4=CC(=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H14N6O5/c23-21(24)11-5-3-4-10(8-11)17-12-9-13(20-6-1-2-7-20)16(22(25)26)15-14(12)18-27-19-15/h3-5,8-9,17H,1-2,6-7H2