4-[3,8-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]butanoic acid

Systemtic Name: 4-[3,8-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]butanoic acid Openeye Name: 4-(3,8-dimethyl-2,6-dioxo-purin-7-yl)butanoic acid CAS Name: 4-(3,8-dimethyl-2,6-dioxo-7-purinyl)butanoic acid IUPAC Name: 4-(3,8-dimethyl-2,6-dioxopurin-7-yl)butanoic acid Traditional Name: 4-(2,6-diketo-3,8-dimethyl-purin-7-yl)butyric acid Formula: C11H14N4O4 MolecularWeight: 266.25326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CCCC(=O)O)C(=O)NC(=O)N2C

Isomeric SMILES

CC1=NC2=C(N1CCCC(=O)O)C(=O)NC(=O)N2C

InChI

InChI=1S/C11H14N4O4/c1-6-12-9-8(10(18)13-11(19)14(9)2)15(6)5-3-4-7(16)17/h3-5H2,1-2H3,(H,16,17)(H,13,18,19)