4-[(6-chloranyl-7H-purin-2-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(6-chloranyl-7H-purin-2-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(6-chloro-7H-purin-2-yl)amino]-4-oxo-butanoic acid CAS Name: 4-[(6-chloro-7H-purin-2-yl)amino]-4-oxobutanoic acid IUPAC Name: 4-[(6-chloro-7H-purin-2-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(6-chloro-7H-purin-2-yl)amino]-4-keto-butyric acid Formula: C9H8ClN5O3 MolecularWeight: 269.64452

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC(=N2)NC(=O)CCC(=O)O)Cl

Isomeric SMILES

C1=NC2=C(N1)C(=NC(=N2)NC(=O)CCC(=O)O)Cl

InChI

InChI=1S/C9H8ClN5O3/c10-7-6-8(12-3-11-6)15-9(14-7)13-4(16)1-2-5(17)18/h3H,1-2H2,(H,17,18)(H2,11,12,13,14,15,16)