(E)-[bis(azanyl)methylideneamino]-[(3-nitro-4-piperidin-1-yl-phenyl)methylidene]azanium

Systemtic Name: (E)-[bis(azanyl)methylideneamino]-[(3-nitro-4-piperidin-1-yl-phenyl)methylidene]azanium Openeye Name: (E)-guanidino-[[3-nitro-4-(1-piperidyl)phenyl]methylene]ammonium CAS Name: (E)-(diaminomethylideneamino)-[[3-nitro-4-(1-piperidinyl)phenyl]methylidene]ammonium IUPAC Name: (E)-(diaminomethylideneamino)-[(3-nitro-4-piperidin-1-ylphenyl)methylidene]azanium Traditional Name: (E)-guanidino-(3-nitro-4-piperidino-benzylidene)ammonium Formula: C13H19N6O2+ MolecularWeight: 291.32896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C=[NH+]N=C(N)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)/C=[NH+]/N=C(N)N)[N+](=O)[O-]

InChI

InChI=1S/C13H18N6O2/c14-13(15)17-16-9-10-4-5-11(12(8-10)19(20)21)18-6-2-1-3-7-18/h4-5,8-9H,1-3,6-7H2,(H4,14,15,17)/p+1/b16-9+