3,9-diethyl-7,8-dihydroimidazo[2,1-f]purin-6-ium perchlorate

Systemtic Name: 3,9-diethyl-7,8-dihydroimidazo[2,1-f]purin-6-ium perchlorate Openeye Name: 3,9-diethyl-7,8-dihydroimidazo[2,1-f]purin-6-ium perchlorate CAS Name: 3,9-diethyl-7,8-dihydroimidazo[2,1-f]purin-6-ium perchlorate IUPAC Name: 3,9-diethyl-7,8-dihydroimidazo[2,1-f]purin-6-ium perchlorate Traditional Name: 3,9-diethyl-7,8-dihydroimidazo[2,1-f]purin-6-ium perchlorate Formula: C11H16ClN5O4 MolecularWeight: 317.72884

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[N+]2=C1C3=C(N=C2)N(C=N3)CC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCN1CC[N+]2=C1C3=C(N=C2)N(C=N3)CC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C11H16N5.ClHO4/c1-3-14-5-6-16-8-13-10-9(11(14)16)12-7-15(10)4-2;2-1(3,4)5/h7-8H,3-6H2,1-2H3;(H,2,3,4,5)/q+1;/p-1