8-[(E)-2-(4-methoxy-2,5-dimethyl-phenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[(E)-2-(4-methoxy-2,5-dimethyl-phenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[(E)-2-(4-methoxy-2,5-dimethyl-phenyl)vinyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[(E)-2-(4-methoxy-2,5-dimethylphenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[(E)-2-(4-methoxy-2,5-dimethylphenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[(E)-2-(4-methoxy-2,5-dimethyl-phenyl)vinyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C=C1/C=C/C2=NC3=C(N2)C(=O)N(C(=O)N3C)C)C)OC

InChI

InChI=1S/C18H20N4O3/c1-10-9-13(25-5)11(2)8-12(10)6-7-14-19-15-16(20-14)21(3)18(24)22(4)17(15)23/h6-9H,1-5H3,(H,19,20)/b7-6+