1,3-dimethyl-7-[(1R)-1-phenylethyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-[(1R)-1-phenylethyl]purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[(1R)-1-phenylethyl]purine-2,6-dione CAS Name: 1,3-dimethyl-7-[(1R)-1-phenylethyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[(1R)-1-phenylethyl]purine-2,6-dione Traditional Name: 1,3-dimethyl-7-[(1R)-1-phenylethyl]xanthine Formula: C15H16N4O2 MolecularWeight: 284.31314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C15H16N4O2/c1-10(11-7-5-4-6-8-11)19-9-16-13-12(19)14(20)18(3)15(21)17(13)2/h4-10H,1-3H3/t10-/m1/s1