8-(2-ethoxyphenyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione

Systemtic Name: 8-(2-ethoxyphenyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione Openeye Name: 8-(2-ethoxyphenyl)-3-isobutyl-1-methyl-7H-purine-2,6-dione CAS Name: 8-(2-ethoxyphenyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione IUPAC Name: 8-(2-ethoxyphenyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione Traditional Name: 3-isobutyl-1-methyl-8-o-phenetyl-7H-purine-2,6-quinone Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC3=C(N2)C(=O)N(C(=O)N3CC(C)C)C

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC3=C(N2)C(=O)N(C(=O)N3CC(C)C)C

InChI

InChI=1S/C18H22N4O3/c1-5-25-13-9-7-6-8-12(13)15-19-14-16(20-15)22(10-11(2)3)18(24)21(4)17(14)23/h6-9,11H,5,10H2,1-4H3,(H,19,20)