3-[(2-chloranyl-7H-purin-6-yl)amino]propanoate

Systemtic Name: 3-[(2-chloranyl-7H-purin-6-yl)amino]propanoate Openeye Name: 3-[(2-chloro-7H-purin-6-yl)amino]propanoate CAS Name: 3-[(2-chloro-7H-purin-6-yl)amino]propanoate IUPAC Name: 3-[(2-chloro-7H-purin-6-yl)amino]propanoate Traditional Name: 3-[(2-chloro-7H-purin-6-yl)amino]propionate Formula: C8H7ClN5O2- MolecularWeight: 240.62648

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC(=N2)Cl)NCCC(=O)[O-]

Isomeric SMILES

C1=NC2=C(N1)C(=NC(=N2)Cl)NCCC(=O)[O-]

InChI

InChI=1S/C8H8ClN5O2/c9-8-13-6(10-2-1-4(15)16)5-7(14-8)12-3-11-5/h3H,1-2H2,(H,15,16)(H2,10,11,12,13,14)/p-1