3-methyl-7-(2-oxidanylidene-2-piperidin-1-yl-ethyl)purine-2,6-dione

Systemtic Name: 3-methyl-7-(2-oxidanylidene-2-piperidin-1-yl-ethyl)purine-2,6-dione Openeye Name: 3-methyl-7-[2-oxo-2-(1-piperidyl)ethyl]purine-2,6-dione CAS Name: 3-methyl-7-[2-oxo-2-(1-piperidinyl)ethyl]purine-2,6-dione IUPAC Name: 3-methyl-7-(2-oxo-2-piperidin-1-ylethyl)purine-2,6-dione Traditional Name: 7-(2-keto-2-piperidino-ethyl)-3-methyl-xanthine Formula: C13H17N5O3 MolecularWeight: 291.30578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)CC(=O)N3CCCCC3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)CC(=O)N3CCCCC3

InChI

InChI=1S/C13H17N5O3/c1-16-11-10(12(20)15-13(16)21)18(8-14-11)7-9(19)17-5-3-2-4-6-17/h8H,2-7H2,1H3,(H,15,20,21)