8-cyclopentyl-3-[2-(4-methoxyphenyl)ethyl]-7H-purine-2,6-dione

Systemtic Name: 8-cyclopentyl-3-[2-(4-methoxyphenyl)ethyl]-7H-purine-2,6-dione Openeye Name: 8-cyclopentyl-3-[2-(4-methoxyphenyl)ethyl]-7H-purine-2,6-dione CAS Name: 8-cyclopentyl-3-[2-(4-methoxyphenyl)ethyl]-7H-purine-2,6-dione IUPAC Name: 8-cyclopentyl-3-[2-(4-methoxyphenyl)ethyl]-7H-purine-2,6-dione Traditional Name: 8-cyclopentyl-3-[2-(4-methoxyphenyl)ethyl]-7H-purine-2,6-quinone Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2C3=C(C(=O)NC2=O)NC(=N3)C4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)CCN2C3=C(C(=O)NC2=O)NC(=N3)C4CCCC4

InChI

InChI=1S/C19H22N4O3/c1-26-14-8-6-12(7-9-14)10-11-23-17-15(18(24)22-19(23)25)20-16(21-17)13-4-2-3-5-13/h6-9,13H,2-5,10-11H2,1H3,(H,20,21)(H,22,24,25)