2-[4-azanyl-5-(pyridin-4-ylmethylamino)pentyl]-1-nitro-guanidine

Systemtic Name: 2-[4-azanyl-5-(pyridin-4-ylmethylamino)pentyl]-1-nitro-guanidine Openeye Name: 2-[4-amino-5-(4-pyridylmethylamino)pentyl]-1-nitro-guanidine CAS Name: 2-[4-amino-5-(pyridin-4-ylmethylamino)pentyl]-1-nitroguanidine IUPAC Name: 2-[4-amino-5-(pyridin-4-ylmethylamino)pentyl]-1-nitroguanidine Traditional Name: 2-[4-amino-5-(4-pyridylmethylamino)pentyl]-1-nitro-guanidine Formula: C12H21N7O2 MolecularWeight: 295.34084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CNCC(CCCN=C(N)N[N+](=O)[O-])N

Isomeric SMILES

C1=CN=CC=C1CNCC(CCCN=C(N)N[N+](=O)[O-])N

InChI

InChI=1S/C12H21N7O2/c13-11(2-1-5-17-12(14)18-19(20)21)9-16-8-10-3-6-15-7-4-10/h3-4,6-7,11,16H,1-2,5,8-9,13H2,(H3,14,17,18)