1,3,7-trimethyl-8-(4-propan-2-ylphenyl)purine-2,6-dione

Systemtic Name: 1,3,7-trimethyl-8-(4-propan-2-ylphenyl)purine-2,6-dione Openeye Name: 8-(4-isopropylphenyl)-1,3,7-trimethyl-purine-2,6-dione CAS Name: 1,3,7-trimethyl-8-(4-propan-2-ylphenyl)purine-2,6-dione IUPAC Name: 1,3,7-trimethyl-8-(4-propan-2-ylphenyl)purine-2,6-dione Traditional Name: 1,3,7-trimethyl-8-p-cumenyl-xanthine Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC3=C(N2C)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC3=C(N2C)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H20N4O2/c1-10(2)11-6-8-12(9-7-11)14-18-15-13(19(14)3)16(22)21(5)17(23)20(15)4/h6-10H,1-5H3