3-methyl-8-(morpholin-4-ylmethyl)-7-phenacyl-purine-2,6-dione

Systemtic Name: 3-methyl-8-(morpholin-4-ylmethyl)-7-phenacyl-purine-2,6-dione Openeye Name: 3-methyl-8-(morpholinomethyl)-7-phenacyl-purine-2,6-dione CAS Name: 3-methyl-8-(4-morpholinylmethyl)-7-phenacylpurine-2,6-dione IUPAC Name: 3-methyl-8-(morpholin-4-ylmethyl)-7-phenacylpurine-2,6-dione Traditional Name: 3-methyl-8-(morpholinomethyl)-7-phenacyl-xanthine Formula: C19H21N5O4 MolecularWeight: 383.40114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)CN3CCOCC3)CC(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)CN3CCOCC3)CC(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H21N5O4/c1-22-17-16(18(26)21-19(22)27)24(11-14(25)13-5-3-2-4-6-13)15(20-17)12-23-7-9-28-10-8-23/h2-6H,7-12H2,1H3,(H,21,26,27)