8-(2,5-dimethylphenoxy)-1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione

Systemtic Name: 8-(2,5-dimethylphenoxy)-1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione Openeye Name: 7-allyl-8-(2,5-dimethylphenoxy)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(2,5-dimethylphenoxy)-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione IUPAC Name: 8-(2,5-dimethylphenoxy)-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione Traditional Name: 7-allyl-8-(2,5-dimethylphenoxy)-1,3-dimethyl-xanthine Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=NC3=C(N2CC=C)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=NC3=C(N2CC=C)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C18H20N4O3/c1-6-9-22-14-15(20(4)18(24)21(5)16(14)23)19-17(22)25-13-10-11(2)7-8-12(13)3/h6-8,10H,1,9H2,2-5H3