3-methyl-8-piperidin-1-yl-7-prop-2-enyl-purine-2,6-dione

Systemtic Name: 3-methyl-8-piperidin-1-yl-7-prop-2-enyl-purine-2,6-dione Openeye Name: 7-allyl-3-methyl-8-(1-piperidyl)purine-2,6-dione CAS Name: 3-methyl-8-(1-piperidinyl)-7-prop-2-enylpurine-2,6-dione IUPAC Name: 3-methyl-8-piperidin-1-yl-7-prop-2-enylpurine-2,6-dione Traditional Name: 7-allyl-3-methyl-8-piperidino-xanthine Formula: C14H19N5O2 MolecularWeight: 289.33296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N5O2/c1-3-7-19-10-11(17(2)14(21)16-12(10)20)15-13(19)18-8-5-4-6-9-18/h3H,1,4-9H2,2H3,(H,16,20,21)