1-[2-[(4-chlorophenyl)methoxy]ethyl]-3-methyl-7-(triphenylmethyl)purine-2,6-dione

Systemtic Name: 1-[2-[(4-chlorophenyl)methoxy]ethyl]-3-methyl-7-(triphenylmethyl)purine-2,6-dione Openeye Name: 1-[2-[(4-chlorophenyl)methoxy]ethyl]-3-methyl-7-trityl-purine-2,6-dione CAS Name: 1-[2-[(4-chlorophenyl)methoxy]ethyl]-3-methyl-7-(triphenylmethyl)purine-2,6-dione IUPAC Name: 1-[2-[(4-chlorophenyl)methoxy]ethyl]-3-methyl-7-tritylpurine-2,6-dione Traditional Name: 1-[2-(4-chlorobenzyl)oxyethyl]-3-methyl-7-trityl-xanthine Formula: C34H29ClN4O3 MolecularWeight: 577.07206

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CCOCC3=CC=C(C=C3)Cl)N(C=N2)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CCOCC3=CC=C(C=C3)Cl)N(C=N2)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H29ClN4O3/c1-37-31-30(32(40)38(33(37)41)21-22-42-23-25-17-19-29(35)20-18-25)39(24-36-31)34(26-11-5-2-6-12-26,27-13-7-3-8-14-27)28-15-9-4-10-16-28/h2-20,24H,21-23H2,1H3