4-(9-methyl-8-oxidanylidene-7H-purin-6-yl)piperazine-1-carboxylic acid

Systemtic Name: 4-(9-methyl-8-oxidanylidene-7H-purin-6-yl)piperazine-1-carboxylic acid Openeye Name: 4-(9-methyl-8-oxo-7H-purin-6-yl)piperazine-1-carboxylic acid CAS Name: 4-(9-methyl-8-oxo-7H-purin-6-yl)-1-piperazinecarboxylic acid IUPAC Name: 4-(9-methyl-8-oxo-7H-purin-6-yl)piperazine-1-carboxylic acid Traditional Name: 4-(8-keto-9-methyl-7H-purin-6-yl)piperazine-1-carboxylic acid Formula: C11H14N6O3 MolecularWeight: 278.26726

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC=N2)N3CCN(CC3)C(=O)O)NC1=O

Isomeric SMILES

CN1C2=C(C(=NC=N2)N3CCN(CC3)C(=O)O)NC1=O

InChI

InChI=1S/C11H14N6O3/c1-15-8-7(14-10(15)18)9(13-6-12-8)16-2-4-17(5-3-16)11(19)20/h6H,2-5H2,1H3,(H,14,18)(H,19,20)