1,3-dimethyl-7-[(1R)-2-oxidanylidene-1,2-diphenyl-ethyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-[(1R)-2-oxidanylidene-1,2-diphenyl-ethyl]purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[(1R)-2-oxo-1,2-diphenyl-ethyl]purine-2,6-dione CAS Name: 1,3-dimethyl-7-[(1R)-2-oxo-1,2-diphenylethyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[(1R)-2-oxo-1,2-diphenylethyl]purine-2,6-dione Traditional Name: 7-[(1R)-2-keto-1,2-diphenyl-ethyl]-1,3-dimethyl-xanthine Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)C(C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)[C@H](C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O3/c1-23-19-17(20(27)24(2)21(23)28)25(13-22-19)16(14-9-5-3-6-10-14)18(26)15-11-7-4-8-12-15/h3-13,16H,1-2H3/t16-/m1/s1