5-nitro-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyridin-2-amine

Systemtic Name: 5-nitro-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyridin-2-amine Openeye Name: 5-nitro-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyridin-2-amine CAS Name: 5-nitro-N-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]-2-pyridinamine IUPAC Name: 5-nitro-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyridin-2-amine Traditional Name: (5-nitro-2-pyridyl)-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]amine Formula: C15H18N5O2+ MolecularWeight: 300.33572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O2/c21-20(22)13-3-4-14(18-11-13)17-10-12-5-6-16-15(9-12)19-7-1-2-8-19/h3-6,9,11H,1-2,7-8,10H2,(H,17,18)/p+1