(E)-cyclohexyl-[1,3-dimethyl-2,6-bis(oxidanylidene)-7,9-dihydropurin-8-ylidene]azanium

Systemtic Name: (E)-cyclohexyl-[1,3-dimethyl-2,6-bis(oxidanylidene)-7,9-dihydropurin-8-ylidene]azanium Openeye Name: (E)-cyclohexyl-(1,3-dimethyl-2,6-dioxo-7,9-dihydropurin-8-ylidene)ammonium CAS Name: (E)-cyclohexyl-(1,3-dimethyl-2,6-dioxo-7,9-dihydropurin-8-ylidene)ammonium IUPAC Name: (E)-cyclohexyl-(1,3-dimethyl-2,6-dioxo-7,9-dihydropurin-8-ylidene)azanium Traditional Name: (E)-cyclohexyl-(2,6-diketo-1,3-dimethyl-7,9-dihydropurin-8-ylidene)ammonium Formula: C13H20N5O2+ MolecularWeight: 278.3302

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=[NH+]C3CCCCC3)N2

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N/C(=[NH+]\C3CCCCC3)/N2

InChI

InChI=1S/C13H19N5O2/c1-17-10-9(11(19)18(2)13(17)20)15-12(16-10)14-8-6-4-3-5-7-8/h8H,3-7H2,1-2H3,(H2,14,15,16)/p+1