3-(2-chlorophenyl)-7-ethyl-1-(oxolan-2-ylmethyl)purine-2,6-dione

Systemtic Name: 3-(2-chlorophenyl)-7-ethyl-1-(oxolan-2-ylmethyl)purine-2,6-dione Openeye Name: 3-(2-chlorophenyl)-7-ethyl-1-(tetrahydrofuran-2-ylmethyl)purine-2,6-dione CAS Name: 3-(2-chlorophenyl)-7-ethyl-1-(2-oxolanylmethyl)purine-2,6-dione IUPAC Name: 3-(2-chlorophenyl)-7-ethyl-1-(oxolan-2-ylmethyl)purine-2,6-dione Traditional Name: 3-(2-chlorophenyl)-7-ethyl-1-(tetrahydrofurfuryl)xanthine Formula: C18H19ClN4O3 MolecularWeight: 374.82146

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C(=O)N(C(=O)N2C3=CC=CC=C3Cl)CC4CCCO4

Isomeric SMILES

CCN1C=NC2=C1C(=O)N(C(=O)N2C3=CC=CC=C3Cl)CC4CCCO4

InChI

InChI=1S/C18H19ClN4O3/c1-2-21-11-20-16-15(21)17(24)22(10-12-6-5-9-26-12)18(25)23(16)14-8-4-3-7-13(14)19/h3-4,7-8,11-12H,2,5-6,9-10H2,1H3