2-[(4S)-4-azanyl-5-(pyridin-3-ylmethylamino)pentyl]-1-nitro-guanidine

Systemtic Name: 2-[(4S)-4-azanyl-5-(pyridin-3-ylmethylamino)pentyl]-1-nitro-guanidine Openeye Name: 2-[(4S)-4-amino-5-(3-pyridylmethylamino)pentyl]-1-nitro-guanidine CAS Name: 2-[(4S)-4-amino-5-(3-pyridinylmethylamino)pentyl]-1-nitroguanidine IUPAC Name: 2-[(4S)-4-amino-5-(pyridin-3-ylmethylamino)pentyl]-1-nitroguanidine Traditional Name: 2-[(4S)-4-amino-5-(3-pyridylmethylamino)pentyl]-1-nitro-guanidine Formula: C12H21N7O2 MolecularWeight: 295.34084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CN=C1)CNC[C@H](CCCN=C(N)N[N+](=O)[O-])N

InChI

InChI=1S/C12H21N7O2/c13-11(4-2-6-17-12(14)18-19(20)21)9-16-8-10-3-1-5-15-7-10/h1,3,5,7,11,16H,2,4,6,8-9,13H2,(H3,14,17,18)/t11-/m0/s1