2-[3-(1-azanylcyclohexyl)phenyl]-1-nitro-guanidine hydrochloride

Systemtic Name: 2-[3-(1-azanylcyclohexyl)phenyl]-1-nitro-guanidine hydrochloride Openeye Name: 2-[3-(1-aminocyclohexyl)phenyl]-1-nitro-guanidine hydrochloride CAS Name: 2-[3-(1-aminocyclohexyl)phenyl]-1-nitroguanidine hydrochloride IUPAC Name: 2-[3-(1-aminocyclohexyl)phenyl]-1-nitroguanidine hydrochloride Traditional Name: 2-[3-(1-aminocyclohexyl)phenyl]-1-nitro-guanidine hydrochloride Formula: C13H20ClN5O2 MolecularWeight: 313.7832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C2=CC(=CC=C2)N=C(N)N[N+](=O)[O-])N.Cl

Isomeric SMILES

C1CCC(CC1)(C2=CC(=CC=C2)N=C(N)N[N+](=O)[O-])N.Cl

InChI

InChI=1S/C13H19N5O2.ClH/c14-12(17-18(19)20)16-11-6-4-5-10(9-11)13(15)7-2-1-3-8-13;/h4-6,9H,1-3,7-8,15H2,(H3,14,16,17);1H