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

Systemtic Name: 8-[(E)-2-(2-chloranyl-3,4-dimethoxy-phenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[(E)-2-(2-chloro-3,4-dimethoxy-phenyl)vinyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[(E)-2-(2-chloro-3,4-dimethoxyphenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[(E)-2-(2-chloro-3,4-dimethoxyphenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[(E)-2-(2-chloro-3,4-dimethoxy-phenyl)vinyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C17H17ClN4O4 MolecularWeight: 376.79428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C=CC3=C(C(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)/C=C/C3=C(C(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C17H17ClN4O4/c1-21-15-13(16(23)22(2)17(21)24)19-11(20-15)8-6-9-5-7-10(25-3)14(26-4)12(9)18/h5-8H,1-4H3,(H,19,20)/b8-6+