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

Systemtic Name: 3,7-dimethyl-8-piperidin-1-yl-1-prop-2-enyl-purine-2,6-dione Openeye Name: 1-allyl-3,7-dimethyl-8-(1-piperidyl)purine-2,6-dione CAS Name: 3,7-dimethyl-8-(1-piperidinyl)-1-prop-2-enylpurine-2,6-dione IUPAC Name: 3,7-dimethyl-8-piperidin-1-yl-1-prop-2-enylpurine-2,6-dione Traditional Name: 1-allyl-3,7-dimethyl-8-piperidino-xanthine Formula: C15H21N5O2 MolecularWeight: 303.35954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1N3CCCCC3)N(C(=O)N(C2=O)CC=C)C

Isomeric SMILES

CN1C2=C(N=C1N3CCCCC3)N(C(=O)N(C2=O)CC=C)C

InChI

InChI=1S/C15H21N5O2/c1-4-8-20-13(21)11-12(18(3)15(20)22)16-14(17(11)2)19-9-6-5-7-10-19/h4H,1,5-10H2,2-3H3