4-[(Z)-2-(2,3-dimethoxyphenyl)-1-methoxy-ethenyl]-3H-purine-2,6-dione

Systemtic Name: 4-[(Z)-2-(2,3-dimethoxyphenyl)-1-methoxy-ethenyl]-3H-purine-2,6-dione Openeye Name: 4-[(Z)-2-(2,3-dimethoxyphenyl)-1-methoxy-vinyl]-3H-purine-2,6-dione CAS Name: 4-[(Z)-2-(2,3-dimethoxyphenyl)-1-methoxyethenyl]-3H-purine-2,6-dione IUPAC Name: 4-[(Z)-2-(2,3-dimethoxyphenyl)-1-methoxyethenyl]-3H-purine-2,6-dione Traditional Name: 4-[(Z)-2-(2,3-dimethoxyphenyl)-1-methoxy-vinyl]xanthine Formula: C16H16N4O5 MolecularWeight: 344.32204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=C(C23C(=NC=N2)C(=O)NC(=O)N3)OC

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=C(/C23C(=NC=N2)C(=O)NC(=O)N3)\OC

InChI

InChI=1S/C16H16N4O5/c1-23-10-6-4-5-9(12(10)25-3)7-11(24-2)16-13(17-8-18-16)14(21)19-15(22)20-16/h4-8H,1-3H3,(H2,19,20,21,22)/b11-7-