azanyl-[2-[3-methyl-2,6-bis(oxidanylidene)-8-piperidin-1-yl-purin-7-yl]ethyl]azanium

Systemtic Name: azanyl-[2-[3-methyl-2,6-bis(oxidanylidene)-8-piperidin-1-yl-purin-7-yl]ethyl]azanium Openeye Name: amino-[2-[3-methyl-2,6-dioxo-8-(1-piperidyl)purin-7-yl]ethyl]ammonium CAS Name: amino-[2-[3-methyl-2,6-dioxo-8-(1-piperidinyl)-7-purinyl]ethyl]ammonium IUPAC Name: amino-[2-(3-methyl-2,6-dioxo-8-piperidin-1-ylpurin-7-yl)ethyl]azanium Traditional Name: amino-[2-(2,6-diketo-3-methyl-8-piperidino-purin-7-yl)ethyl]ammonium Formula: C13H22N7O2+ MolecularWeight: 308.35948

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCCC3)CC[NH2+]N

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCCC3)CC[NH2+]N

InChI

InChI=1S/C13H21N7O2/c1-18-10-9(11(21)17-13(18)22)20(8-5-15-14)12(16-10)19-6-3-2-4-7-19/h15H,2-8,14H2,1H3,(H,17,21,22)/p+1