8-[(E)-2-(4-methoxy-2,3-dimethyl-phenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[(E)-2-(4-methoxy-2,3-dimethyl-phenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[(E)-2-(4-methoxy-2,3-dimethyl-phenyl)vinyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[(E)-2-(4-methoxy-2,3-dimethylphenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[(E)-2-(4-methoxy-2,3-dimethylphenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[(E)-2-(4-methoxy-2,3-dimethyl-phenyl)vinyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C18H20N4O3 MolecularWeight: 340.3764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OC)C=CC2=NC3=C(N2)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=C(C=CC(=C1C)OC)/C=C/C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C18H20N4O3/c1-10-11(2)13(25-5)8-6-12(10)7-9-14-19-15-16(20-14)21(3)18(24)22(4)17(15)23/h6-9H,1-5H3,(H,19,20)/b9-7+