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

Systemtic Name: 1-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]decan-1-olate Openeye Name: 1-(1,3-dimethyl-2,6-dioxo-purin-7-yl)decan-1-olate CAS Name: 1-(1,3-dimethyl-2,6-dioxo-7-purinyl)-1-decanolate IUPAC Name: 1-(1,3-dimethyl-2,6-dioxopurin-7-yl)decan-1-olate Traditional Name: 1-(2,6-diketo-1,3-dimethyl-purin-7-yl)decan-1-olate Formula: C17H27N4O3- MolecularWeight: 335.42128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(N1C=NC2=C1C(=O)N(C(=O)N2C)C)[O-]

Isomeric SMILES

CCCCCCCCCC(N1C=NC2=C1C(=O)N(C(=O)N2C)C)[O-]

InChI

InChI=1S/C17H27N4O3/c1-4-5-6-7-8-9-10-11-13(22)21-12-18-15-14(21)16(23)20(3)17(24)19(15)2/h12-13H,4-11H2,1-3H3/q-1