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

Systemtic Name: 8-cyclopentyl-3-(phenylmethyl)-7H-purine-2,6-dione Openeye Name: 3-benzyl-8-cyclopentyl-7H-purine-2,6-dione CAS Name: 8-cyclopentyl-3-(phenylmethyl)-7H-purine-2,6-dione IUPAC Name: 3-benzyl-8-cyclopentyl-7H-purine-2,6-dione Traditional Name: 3-benzyl-8-cyclopentyl-7H-purine-2,6-quinone Formula: C17H18N4O2 MolecularWeight: 310.35042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NC3=C(N2)C(=O)NC(=O)N3CC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)C2=NC3=C(N2)C(=O)NC(=O)N3CC4=CC=CC=C4

InChI

InChI=1S/C17H18N4O2/c22-16-13-15(19-14(18-13)12-8-4-5-9-12)21(17(23)20-16)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,18,19)(H,20,22,23)