1-[(3-aminocarbonylpyridin-1-ium-1-yl)methyl]pyridin-1-ium-3-carboxamide iodide

Systemtic Name: 1-[(3-aminocarbonylpyridin-1-ium-1-yl)methyl]pyridin-1-ium-3-carboxamide iodide Openeye Name: 1-[(3-carbamoylpyridin-1-ium-1-yl)methyl]pyridin-1-ium-3-carboxamide iodide CAS Name: 1-[(3-carbamoyl-1-pyridin-1-iumyl)methyl]-3-pyridin-1-iumcarboxamide iodide IUPAC Name: 1-[(3-carbamoylpyridin-1-ium-1-yl)methyl]pyridin-1-ium-3-carboxamide iodide Traditional Name: 1-[(3-carbamoylpyridin-1-ium-1-yl)methyl]pyridin-1-ium-3-carboxamide iodide Formula: C13H14IN4O2+ MolecularWeight: 385.18033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)C[N+]2=CC=CC(=C2)C(=O)N)C(=O)N.[I-]

Isomeric SMILES

C1=CC(=C[N+](=C1)C[N+]2=CC=CC(=C2)C(=O)N)C(=O)N.[I-]

InChI

InChI=1S/C13H12N4O2.HI/c14-12(18)10-3-1-5-16(7-10)9-17-6-2-4-11(8-17)13(15)19;/h1-8H,9H2,(H2-2,14,15,18,19);1H/p+1