2-[(2-azanylpurin-9-yl)methyl]butanedioate

Systemtic Name: 2-[(2-azanylpurin-9-yl)methyl]butanedioate Openeye Name: 2-[(2-aminopurin-9-yl)methyl]butanedioate CAS Name: 2-[(2-amino-9-purinyl)methyl]butanedioate IUPAC Name: 2-[(2-aminopurin-9-yl)methyl]butanedioate Traditional Name: 2-[(2-aminopurin-9-yl)methyl]succinate Formula: C10H9N5O4-2 MolecularWeight: 263.20956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N5O4/c11-10-12-2-6-8(14-10)15(4-13-6)3-5(9(18)19)1-7(16)17/h2,4-5H,1,3H2,(H,16,17)(H,18,19)(H2,11,12,14)/p-2