8-(2-methoxyphenoxy)-1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione

Systemtic Name: 8-(2-methoxyphenoxy)-1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione Openeye Name: 7-allyl-8-(2-methoxyphenoxy)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(2-methoxyphenoxy)-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione IUPAC Name: 8-(2-methoxyphenoxy)-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione Traditional Name: 7-allyl-8-(2-methoxyphenoxy)-1,3-dimethyl-xanthine Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=CC=C3OC)CC=C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=CC=C3OC)CC=C

InChI

InChI=1S/C17H18N4O4/c1-5-10-21-13-14(19(2)17(23)20(3)15(13)22)18-16(21)25-12-9-7-6-8-11(12)24-4/h5-9H,1,10H2,2-4H3