1-[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone

Systemtic Name: 1-[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone Openeye Name: 1-[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone CAS Name: 1-[2-[2,1,3-benzoxadiazol-5-yl(oxo)methyl]-1-pyrazolidinyl]-2-(2-nitrophenoxy)ethanone IUPAC Name: 1-[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone Traditional Name: 1-[2-(benzofurazan-5-carbonyl)pyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone Formula: C18H15N5O6 MolecularWeight: 397.3416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)C2=CC3=NON=C3C=C2)C(=O)COC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(N(C1)C(=O)C2=CC3=NON=C3C=C2)C(=O)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O6/c24-17(11-28-16-5-2-1-4-15(16)23(26)27)21-8-3-9-22(21)18(25)12-6-7-13-14(10-12)20-29-19-13/h1-2,4-7,10H,3,8-9,11H2