8-ethenyl-1,3-dimethyl-7-prop-2-ynyl-purine-2,6-dione

Systemtic Name: 8-ethenyl-1,3-dimethyl-7-prop-2-ynyl-purine-2,6-dione Openeye Name: 1,3-dimethyl-7-prop-2-ynyl-8-vinyl-purine-2,6-dione CAS Name: 8-ethenyl-1,3-dimethyl-7-prop-2-ynylpurine-2,6-dione IUPAC Name: 8-ethenyl-1,3-dimethyl-7-prop-2-ynylpurine-2,6-dione Traditional Name: 1,3-dimethyl-7-propargyl-8-vinyl-xanthine Formula: C12H12N4O2 MolecularWeight: 244.24928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O2/c1-5-7-16-8(6-2)13-10-9(16)11(17)15(4)12(18)14(10)3/h1,6H,2,7H2,3-4H3