3-phenyl-2-(5H-purin-6-ylamino)propanoic acid

Systemtic Name: 3-phenyl-2-(5H-purin-6-ylamino)propanoic acid Openeye Name: 3-phenyl-2-(5H-purin-6-ylamino)propanoic acid CAS Name: 3-phenyl-2-(5H-purin-6-ylamino)propanoic acid IUPAC Name: 3-phenyl-2-(5H-purin-6-ylamino)propanoic acid Traditional Name: 3-phenyl-2-(5H-purin-6-ylamino)propionic acid Formula: C14H13N5O2 MolecularWeight: 283.28532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC2=NC=NC3=NC=NC32

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC2=NC=NC3=NC=NC32

InChI

InChI=1S/C14H13N5O2/c20-14(21)10(6-9-4-2-1-3-5-9)19-13-11-12(16-7-15-11)17-8-18-13/h1-5,7-8,10-11H,6H2,(H,20,21)(H,15,16,17,18,19)