7-[3-(4-methoxyphenoxy)-2-oxidanyl-propyl]-3-methyl-8-[2-(phenylmethylidene)hydrazinyl]purine-2,6-dione

Systemtic Name: 7-[3-(4-methoxyphenoxy)-2-oxidanyl-propyl]-3-methyl-8-[2-(phenylmethylidene)hydrazinyl]purine-2,6-dione Openeye Name: 8-(2-benzylidenehydrazino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methyl-purine-2,6-dione CAS Name: 7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methyl-8-[2-(phenylmethylene)hydrazinyl]purine-2,6-dione IUPAC Name: 8-(2-benzylidenehydrazinyl)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione Traditional Name: 8-(N'-benzalhydrazino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methyl-xanthine Formula: C23H24N6O5 MolecularWeight: 464.47386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC=CC=C3)CC(COC4=CC=C(C=C4)OC)O

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC=CC=C3)CC(COC4=CC=C(C=C4)OC)O

InChI

InChI=1S/C23H24N6O5/c1-28-20-19(21(31)26-23(28)32)29(22(25-20)27-24-12-15-6-4-3-5-7-15)13-16(30)14-34-18-10-8-17(33-2)9-11-18/h3-12,16,30H,13-14H2,1-2H3,(H,25,27)(H,26,31,32)