8-ethenyl-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione

Systemtic Name: 8-ethenyl-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione Openeye Name: 7-benzyl-1,3-dimethyl-8-vinyl-purine-2,6-dione CAS Name: 8-ethenyl-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 7-benzyl-8-ethenyl-1,3-dimethylpurine-2,6-dione Traditional Name: 7-benzyl-1,3-dimethyl-8-vinyl-xanthine Formula: C16H16N4O2 MolecularWeight: 296.32384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C=C)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C=C)CC3=CC=CC=C3

InChI

InChI=1S/C16H16N4O2/c1-4-12-17-14-13(15(21)19(3)16(22)18(14)2)20(12)10-11-8-6-5-7-9-11/h4-9H,1,10H2,2-3H3