(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-azanyl-4-methyl-pentanoate

Systemtic Name: (4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-azanyl-4-methyl-pentanoate Openeye Name: (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-amino-4-methyl-pentanoate CAS Name: 2-amino-4-methylpentanoic acid (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl ester IUPAC Name: (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-amino-4-methylpentanoate Traditional Name: 2-amino-4-methyl-valeric acid (4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl ester Formula: C12H17N5O3 MolecularWeight: 279.29508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCN1C2=NC=NC(=O)C2=CN1)N

Isomeric SMILES

CC(C)CC(C(=O)OCN1C2=NC=NC(=O)C2=CN1)N

InChI

InChI=1S/C12H17N5O3/c1-7(2)3-9(13)12(19)20-6-17-10-8(4-16-17)11(18)15-5-14-10/h4-5,7,9,16H,3,6,13H2,1-2H3