2-purin-9-ylethanoic acid

Systemtic Name: 2-purin-9-ylethanoic acid Openeye Name: 2-purin-9-ylacetic acid CAS Name: 2-(9-purinyl)acetic acid IUPAC Name: 2-purin-9-ylacetic acid Traditional Name: 2-purin-9-ylacetic acid Formula: C7H6N4O2 MolecularWeight: 178.14814

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC=N1)N(C=N2)CC(=O)O

Isomeric SMILES

C1=C2C(=NC=N1)N(C=N2)CC(=O)O

InChI

InChI=1S/C7H6N4O2/c12-6(13)2-11-4-10-5-1-8-3-9-7(5)11/h1,3-4H,2H2,(H,12,13)