1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-naphthalen-2-yloxy-purine-2,6-dione

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-naphthalen-2-yloxy-purine-2,6-dione Openeye Name: 1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-(2-naphthyloxy)purine-2,6-dione CAS Name: 1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-(2-naphthalenyloxy)purine-2,6-dione IUPAC Name: 1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-naphthalen-2-yloxypurine-2,6-dione Traditional Name: 1-(4-chlorobenzyl)-3,7-dimethyl-8-(2-naphthoxy)xanthine Formula: C24H19ClN4O3 MolecularWeight: 446.88566

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1OC3=CC4=CC=CC=C4C=C3)N(C(=O)N(C2=O)CC5=CC=C(C=C5)Cl)C

Isomeric SMILES

CN1C2=C(N=C1OC3=CC4=CC=CC=C4C=C3)N(C(=O)N(C2=O)CC5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C24H19ClN4O3/c1-27-20-21(26-23(27)32-19-12-9-16-5-3-4-6-17(16)13-19)28(2)24(31)29(22(20)30)14-15-7-10-18(25)11-8-15/h3-13H,14H2,1-2H3