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

Systemtic Name: 8-cyclopentyl-3-(2-methoxyethyl)-7-(phenylmethyl)purine-2,6-dione Openeye Name: 7-benzyl-8-cyclopentyl-3-(2-methoxyethyl)purine-2,6-dione CAS Name: 8-cyclopentyl-3-(2-methoxyethyl)-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 7-benzyl-8-cyclopentyl-3-(2-methoxyethyl)purine-2,6-dione Traditional Name: 7-benzyl-8-cyclopentyl-3-(2-methoxyethyl)xanthine Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C(=O)NC1=O)N(C(=N2)C3CCCC3)CC4=CC=CC=C4

Isomeric SMILES

COCCN1C2=C(C(=O)NC1=O)N(C(=N2)C3CCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H24N4O3/c1-27-12-11-23-18-16(19(25)22-20(23)26)24(13-14-7-3-2-4-8-14)17(21-18)15-9-5-6-10-15/h2-4,7-8,15H,5-6,9-13H2,1H3,(H,22,25,26)