8-diazanyl-3-methyl-7-(2-oxidanyl-3-phenoxy-propyl)purine-2,6-dione

Systemtic Name: 8-diazanyl-3-methyl-7-(2-oxidanyl-3-phenoxy-propyl)purine-2,6-dione Openeye Name: 8-hydrazino-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione CAS Name: 8-hydrazinyl-7-(2-hydroxy-3-phenoxypropyl)-3-methylpurine-2,6-dione IUPAC Name: 8-hydrazinyl-7-(2-hydroxy-3-phenoxypropyl)-3-methylpurine-2,6-dione Traditional Name: 8-hydrazino-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-xanthine Formula: C15H18N6O4 MolecularWeight: 346.34122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN)CC(COC3=CC=CC=C3)O

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN)CC(COC3=CC=CC=C3)O

InChI

InChI=1S/C15H18N6O4/c1-20-12-11(13(23)18-15(20)24)21(14(17-12)19-16)7-9(22)8-25-10-5-3-2-4-6-10/h2-6,9,22H,7-8,16H2,1H3,(H,17,19)(H,18,23,24)