7-[1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-(2-indan-5-yl-1-methyl-2-oxo-ethyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(2-indan-5-yl-2-keto-1-methyl-ethyl)-1,3-dimethyl-xanthine Formula: C19H20N4O3 MolecularWeight: 352.3871

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)N3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CC(C(=O)C1=CC2=C(CCC2)C=C1)N3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C19H20N4O3/c1-11(16(24)14-8-7-12-5-4-6-13(12)9-14)23-10-20-17-15(23)18(25)22(3)19(26)21(17)2/h7-11H,4-6H2,1-3H3