2-(7H-purin-6-ylcarbamoylamino)ethanoic acid

Systemtic Name: 2-(7H-purin-6-ylcarbamoylamino)ethanoic acid Openeye Name: 2-(7H-purin-6-ylcarbamoylamino)acetic acid CAS Name: 2-[[oxo-(7H-purin-6-ylamino)methyl]amino]acetic acid IUPAC Name: 2-(7H-purin-6-ylcarbamoylamino)acetic acid Traditional Name: 2-(7H-purin-6-ylcarbamoylamino)acetic acid Formula: C8H8N6O3 MolecularWeight: 236.18752

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC=N2)NC(=O)NCC(=O)O

Isomeric SMILES

C1=NC2=C(N1)C(=NC=N2)NC(=O)NCC(=O)O

InChI

InChI=1S/C8H8N6O3/c15-4(16)1-9-8(17)14-7-5-6(11-2-10-5)12-3-13-7/h2-3H,1H2,(H,15,16)(H3,9,10,11,12,13,14,17)