1-methyl-3-(2-methylpropyl)-2-oxidanylidene-purin-6-olate; tetramethylazanium

Systemtic Name: 1-methyl-3-(2-methylpropyl)-2-oxidanylidene-purin-6-olate; tetramethylazanium Openeye Name: 3-isobutyl-1-methyl-2-oxo-purin-6-olate; tetramethylammonium CAS Name: 1-methyl-3-(2-methylpropyl)-2-oxo-6-purinolate; tetramethylammonium IUPAC Name: 1-methyl-3-(2-methylpropyl)-2-oxopurin-6-olate; tetramethylazanium Traditional Name: 3-isobutyl-2-keto-1-methyl-purin-6-olate; tetramethylammonium Formula: C14H25N5O2 MolecularWeight: 295.3806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=NC=NC2=C(N(C1=O)C)[O-].C[N+](C)(C)C

Isomeric SMILES

CC(C)CN1C2=NC=NC2=C(N(C1=O)C)[O-].C[N+](C)(C)C

InChI

InChI=1S/C10H14N4O2.C4H12N/c1-6(2)4-14-8-7(11-5-12-8)9(15)13(3)10(14)16;1-5(2,3)4/h5-6,15H,4H2,1-3H3;1-4H3/q;+1/p-1