2-(2-azanyl-6-oxidanylidene-7H-purin-1-yl)propanoic acid

Systemtic Name: 2-(2-azanyl-6-oxidanylidene-7H-purin-1-yl)propanoic acid Openeye Name: 2-(2-amino-6-oxo-7H-purin-1-yl)propanoic acid CAS Name: 2-(2-amino-6-oxo-7H-purin-1-yl)propanoic acid IUPAC Name: 2-(2-amino-6-oxo-7H-purin-1-yl)propanoic acid Traditional Name: 2-(2-amino-6-keto-7H-purin-1-yl)propionic acid Formula: C8H9N5O3 MolecularWeight: 223.18876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(=O)C2=C(N=CN2)N=C1N

Isomeric SMILES

CC(C(=O)O)N1C(=O)C2=C(N=CN2)N=C1N

InChI

InChI=1S/C8H9N5O3/c1-3(7(15)16)13-6(14)4-5(11-2-10-4)12-8(13)9/h2-3H,1H3,(H2,9,12)(H,10,11)(H,15,16)