N-cyclooctyl-3-nitro-pyridin-1-ium-4-amine

Systemtic Name: N-cyclooctyl-3-nitro-pyridin-1-ium-4-amine Openeye Name: N-cyclooctyl-3-nitro-pyridin-1-ium-4-amine CAS Name: N-cyclooctyl-3-nitro-4-pyridin-1-iumamine IUPAC Name: N-cyclooctyl-3-nitropyridin-1-ium-4-amine Traditional Name: cyclooctyl-(3-nitropyridin-1-ium-4-yl)amine Formula: C13H20N3O2+ MolecularWeight: 250.3168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC2=C(C=[NH+]C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CCC1)NC2=C(C=[NH+]C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O2/c17-16(18)13-10-14-9-8-12(13)15-11-6-4-2-1-3-5-7-11/h8-11H,1-7H2,(H,14,15)/p+1