2-(8-oxidanylidene-2-phenyl-7H-purin-9-yl)ethanoic acid

Systemtic Name: 2-(8-oxidanylidene-2-phenyl-7H-purin-9-yl)ethanoic acid Openeye Name: 2-(8-oxo-2-phenyl-7H-purin-9-yl)acetic acid CAS Name: 2-(8-oxo-2-phenyl-7H-purin-9-yl)acetic acid IUPAC Name: 2-(8-oxo-2-phenyl-7H-purin-9-yl)acetic acid Traditional Name: 2-(8-keto-2-phenyl-7H-purin-9-yl)acetic acid Formula: C13H10N4O3 MolecularWeight: 270.2435

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=C3C(=N2)N(C(=O)N3)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=C3C(=N2)N(C(=O)N3)CC(=O)O

InChI

InChI=1S/C13H10N4O3/c18-10(19)7-17-12-9(15-13(17)20)6-14-11(16-12)8-4-2-1-3-5-8/h1-6H,7H2,(H,15,20)(H,18,19)