2-(3-nitro-1,2,4-triazol-1-yl)-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(3-nitro-1,2,4-triazol-1-yl)-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(3-nitro-1,2,4-triazol-1-yl)-1-pyrrolidin-1-yl-ethanone CAS Name: 2-(3-nitro-1,2,4-triazol-1-yl)-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(3-nitro-1,2,4-triazol-1-yl)-1-pyrrolidin-1-ylethanone Traditional Name: 2-(3-nitro-1,2,4-triazol-1-yl)-1-pyrrolidino-ethanone Formula: C8H11N5O3 MolecularWeight: 225.20464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C=NC(=N2)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)CN2C=NC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C8H11N5O3/c14-7(11-3-1-2-4-11)5-12-6-9-8(10-12)13(15)16/h6H,1-5H2