8-cyclopentyl-3-methoxy-7-(phenylmethyl)purine-2,6-dione

Systemtic Name: 8-cyclopentyl-3-methoxy-7-(phenylmethyl)purine-2,6-dione Openeye Name: 7-benzyl-8-cyclopentyl-3-methoxy-purine-2,6-dione CAS Name: 8-cyclopentyl-3-methoxy-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 7-benzyl-8-cyclopentyl-3-methoxypurine-2,6-dione Traditional Name: 7-benzyl-8-cyclopentyl-3-methoxy-xanthine Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CON1C2=C(C(=O)NC1=O)N(C(=N2)C3CCCC3)CC4=CC=CC=C4

Isomeric SMILES

CON1C2=C(C(=O)NC1=O)N(C(=N2)C3CCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C18H20N4O3/c1-25-22-16-14(17(23)20-18(22)24)21(11-12-7-3-2-4-8-12)15(19-16)13-9-5-6-10-13/h2-4,7-8,13H,5-6,9-11H2,1H3,(H,20,23,24)