2-[(6-oxidanylidene-3H-purin-9-yl)methyl]butanedioic acid

Systemtic Name: 2-[(6-oxidanylidene-3H-purin-9-yl)methyl]butanedioic acid Openeye Name: 2-[(6-oxo-3H-purin-9-yl)methyl]butanedioic acid CAS Name: 2-[(6-oxo-3H-purin-9-yl)methyl]butanedioic acid IUPAC Name: 2-[(6-oxo-3H-purin-9-yl)methyl]butanedioic acid Traditional Name: 2-[(6-keto-3H-purin-9-yl)methyl]succinic acid Formula: C10H10N4O5 MolecularWeight: 266.2102

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N(C=N2)CC(CC(=O)O)C(=O)O

Isomeric SMILES

C1=NC(=O)C2=C(N1)N(C=N2)CC(CC(=O)O)C(=O)O

InChI

InChI=1S/C10H10N4O5/c15-6(16)1-5(10(18)19)2-14-4-13-7-8(14)11-3-12-9(7)17/h3-5H,1-2H2,(H,15,16)(H,18,19)(H,11,12,17)