4,4-dimethyl-2-[(8-oxidanylidene-7,9-dihydropurin-6-yl)amino]pentanoic acid

Systemtic Name: 4,4-dimethyl-2-[(8-oxidanylidene-7,9-dihydropurin-6-yl)amino]pentanoic acid Openeye Name: 4,4-dimethyl-2-[(8-oxo-7,9-dihydropurin-6-yl)amino]pentanoic acid CAS Name: 4,4-dimethyl-2-[(8-oxo-7,9-dihydropurin-6-yl)amino]pentanoic acid IUPAC Name: 4,4-dimethyl-2-[(8-oxo-7,9-dihydropurin-6-yl)amino]pentanoic acid Traditional Name: 2-[(8-keto-7,9-dihydropurin-6-yl)amino]-4,4-dimethyl-valeric acid Formula: C12H17N5O3 MolecularWeight: 279.29508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)O)NC1=NC=NC2=C1NC(=O)N2

Isomeric SMILES

CC(C)(C)CC(C(=O)O)NC1=NC=NC2=C1NC(=O)N2

InChI

InChI=1S/C12H17N5O3/c1-12(2,3)4-6(10(18)19)15-8-7-9(14-5-13-8)17-11(20)16-7/h5-6H,4H2,1-3H3,(H,18,19)(H3,13,14,15,16,17,20)