2-azanyl-8-ethyl-5,8a-dihydro-1H-pteridin-1-ium-4,6-diol iodide

Systemtic Name: 2-azanyl-8-ethyl-5,8a-dihydro-1H-pteridin-1-ium-4,6-diol iodide Openeye Name: 2-amino-8-ethyl-5,8a-dihydro-1H-pteridin-1-ium-4,6-diol iodide CAS Name: 2-amino-8-ethyl-5,8a-dihydro-1H-pteridin-1-ium-4,6-diol iodide IUPAC Name: 2-amino-8-ethyl-5,8a-dihydro-1H-pteridin-1-ium-4,6-diol iodide Traditional Name: 2-amino-8-ethyl-5,8a-dihydro-1H-pteridin-1-ium-4,6-diol iodide Formula: C8H14IN5O2 MolecularWeight: 339.13353

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(NC2=C(N=C([NH2+]C21)N)O)O.[I-]

Isomeric SMILES

CCN1C=C(NC2=C(N=C([NH2+]C21)N)O)O.[I-]

InChI

InChI=1S/C8H13N5O2.HI/c1-2-13-3-4(14)10-5-6(13)11-8(9)12-7(5)15;/h3,6,10,14-15H,2H2,1H3,(H3,9,11,12);1H