5-[1-methyl-2,6-bis(oxidanylidene)-7H-purin-3-yl]pentanoic acid

Systemtic Name: 5-[1-methyl-2,6-bis(oxidanylidene)-7H-purin-3-yl]pentanoic acid Openeye Name: 5-(1-methyl-2,6-dioxo-7H-purin-3-yl)pentanoic acid CAS Name: 5-(1-methyl-2,6-dioxo-7H-purin-3-yl)pentanoic acid IUPAC Name: 5-(1-methyl-2,6-dioxo-7H-purin-3-yl)pentanoic acid Traditional Name: 5-(2,6-diketo-1-methyl-7H-purin-3-yl)valeric acid Formula: C11H14N4O4 MolecularWeight: 266.25326

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=CN2)N(C1=O)CCCCC(=O)O

Isomeric SMILES

CN1C(=O)C2=C(N=CN2)N(C1=O)CCCCC(=O)O

InChI

InChI=1S/C11H14N4O4/c1-14-10(18)8-9(13-6-12-8)15(11(14)19)5-3-2-4-7(16)17/h6H,2-5H2,1H3,(H,12,13)(H,16,17)