1-azanyl-N-[4-[(1-azanylpyridin-1-ium-3-yl)carbonylamino]butyl]pyridin-1-ium-3-carboxamide diiodide

Systemtic Name: 1-azanyl-N-[4-[(1-azanylpyridin-1-ium-3-yl)carbonylamino]butyl]pyridin-1-ium-3-carboxamide diiodide Openeye Name: 1-amino-N-[4-[(1-aminopyridin-1-ium-3-carbonyl)amino]butyl]pyridin-1-ium-3-carboxamide diiodide CAS Name: 1-amino-N-[4-[[(1-amino-3-pyridin-1-iumyl)-oxomethyl]amino]butyl]-3-pyridin-1-iumcarboxamide diiodide IUPAC Name: 1-amino-N-[4-[(1-aminopyridin-1-ium-3-carbonyl)amino]butyl]pyridin-1-ium-3-carboxamide diiodide Traditional Name: 1-amino-N-[4-[(1-aminopyridin-1-ium-3-carbonyl)amino]butyl]pyridin-1-ium-3-carboxamide diiodide Formula: C16H22I2N6O2 MolecularWeight: 584.19382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N6O2.2HI/c17-21-9-3-5-13(11-21)15(23)19-7-1-2-8-20-16(24)14-6-4-10-22(18)12-14;;/h3-6,9-12H,1-2,7-8,17-18H2;2*1H