2-cyano-3-nitro-1-(7-oxidanylideneheptyl)-1-pyrrolidin-1-yl-guanidine

Systemtic Name: 2-cyano-3-nitro-1-(7-oxidanylideneheptyl)-1-pyrrolidin-1-yl-guanidine Openeye Name: 2-cyano-3-nitro-1-(7-oxoheptyl)-1-pyrrolidin-1-yl-guanidine CAS Name: 2-cyano-3-nitro-1-(7-oxoheptyl)-1-(1-pyrrolidinyl)guanidine IUPAC Name: 2-cyano-3-nitro-1-(7-oxoheptyl)-1-pyrrolidin-1-ylguanidine Traditional Name: 2-cyano-1-(7-ketoheptyl)-3-nitro-1-pyrrolidino-guanidine Formula: C13H22N6O3 MolecularWeight: 310.35218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)N(CCCCCCC=O)C(=NC#N)N[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)N(CCCCCCC=O)C(=NC#N)N[N+](=O)[O-]

InChI

InChI=1S/C13H22N6O3/c14-12-15-13(16-19(21)22)18(17-8-5-6-9-17)10-4-2-1-3-7-11-20/h11H,1-10H2,(H,15,16)