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

Systemtic Name: 8-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]octan-1-olate Openeye Name: 8-(3,7-dimethyl-2,6-dioxo-purin-1-yl)octan-1-olate CAS Name: 8-(3,7-dimethyl-2,6-dioxo-1-purinyl)-1-octanolate IUPAC Name: 8-(3,7-dimethyl-2,6-dioxopurin-1-yl)octan-1-olate Traditional Name: 8-(2,6-diketo-3,7-dimethyl-purin-1-yl)octan-1-olate Formula: C15H23N4O3- MolecularWeight: 307.36812

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCC[O-]

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCC[O-]

InChI

InChI=1S/C15H23N4O3/c1-17-11-16-13-12(17)14(21)19(15(22)18(13)2)9-7-5-3-4-6-8-10-20/h11H,3-10H2,1-2H3/q-1