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

Systemtic Name: 8-methoxy-1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione Openeye Name: 7-allyl-8-methoxy-1,3-dimethyl-purine-2,6-dione CAS Name: 8-methoxy-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione IUPAC Name: 8-methoxy-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione Traditional Name: 7-allyl-8-methoxy-1,3-dimethyl-xanthine Formula: C11H14N4O3 MolecularWeight: 250.25386

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC)CC=C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC)CC=C

InChI

InChI=1S/C11H14N4O3/c1-5-6-15-7-8(12-10(15)18-4)13(2)11(17)14(3)9(7)16/h5H,1,6H2,2-4H3