1-[(E)-2-(4-methoxyphenyl)ethenyl]-7-methyl-3H-purine-2,6-dione

Systemtic Name: 1-[(E)-2-(4-methoxyphenyl)ethenyl]-7-methyl-3H-purine-2,6-dione Openeye Name: 1-[(E)-2-(4-methoxyphenyl)vinyl]-7-methyl-3H-purine-2,6-dione CAS Name: 1-[(E)-2-(4-methoxyphenyl)ethenyl]-7-methyl-3H-purine-2,6-dione IUPAC Name: 1-[(E)-2-(4-methoxyphenyl)ethenyl]-7-methyl-3H-purine-2,6-dione Traditional Name: 1-[(E)-2-(4-methoxyphenyl)vinyl]-7-methyl-xanthine Formula: C15H14N4O3 MolecularWeight: 298.29666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2)C=CC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2)/C=C/C3=CC=C(C=C3)OC

InChI

InChI=1S/C15H14N4O3/c1-18-9-16-13-12(18)14(20)19(15(21)17-13)8-7-10-3-5-11(22-2)6-4-10/h3-9H,1-2H3,(H,17,21)/b8-7+