8-(4-cyclopentyloxy-3-methoxy-phenyl)-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-(4-cyclopentyloxy-3-methoxy-phenyl)-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[4-(cyclopentoxy)-3-methoxy-phenyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-(4-cyclopentyloxy-3-methoxyphenyl)-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-(4-cyclopentyloxy-3-methoxyphenyl)-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[4-(cyclopentoxy)-3-methoxy-phenyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C19H22N4O4 MolecularWeight: 370.40238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC(=C(C=C3)OC4CCCC4)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC(=C(C=C3)OC4CCCC4)OC

InChI

InChI=1S/C19H22N4O4/c1-22-17-15(18(24)23(2)19(22)25)20-16(21-17)11-8-9-13(14(10-11)26-3)27-12-6-4-5-7-12/h8-10,12H,4-7H2,1-3H3,(H,20,21)