2-[1,3-dimethyl-2,6-bis(oxidanylidene)-8-piperidin-1-yl-purin-7-yl]ethylazanium

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)-8-piperidin-1-yl-purin-7-yl]ethylazanium Openeye Name: 2-[1,3-dimethyl-2,6-dioxo-8-(1-piperidyl)purin-7-yl]ethylammonium CAS Name: 2-[1,3-dimethyl-2,6-dioxo-8-(1-piperidinyl)-7-purinyl]ethylammonium IUPAC Name: 2-(1,3-dimethyl-2,6-dioxo-8-piperidin-1-ylpurin-7-yl)ethylazanium Traditional Name: 2-(2,6-diketo-1,3-dimethyl-8-piperidino-purin-7-yl)ethylammonium Formula: C14H23N6O2+ MolecularWeight: 307.37142

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CC[NH3+]

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CC[NH3+]

InChI

InChI=1S/C14H22N6O2/c1-17-11-10(12(21)18(2)14(17)22)20(9-6-15)13(16-11)19-7-4-3-5-8-19/h3-9,15H2,1-2H3/p+1