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

Systemtic Name: 3-methyl-8-(morpholin-4-ylmethyl)-7-(3-oxidanylpropyl)purine-2,6-dione Openeye Name: 7-(3-hydroxypropyl)-3-methyl-8-(morpholinomethyl)purine-2,6-dione CAS Name: 7-(3-hydroxypropyl)-3-methyl-8-(4-morpholinylmethyl)purine-2,6-dione IUPAC Name: 7-(3-hydroxypropyl)-3-methyl-8-(morpholin-4-ylmethyl)purine-2,6-dione Traditional Name: 7-(3-hydroxypropyl)-3-methyl-8-(morpholinomethyl)xanthine Formula: C14H21N5O4 MolecularWeight: 323.34764

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)CN3CCOCC3)CCCO

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)CN3CCOCC3)CCCO

InChI

InChI=1S/C14H21N5O4/c1-17-12-11(13(21)16-14(17)22)19(3-2-6-20)10(15-12)9-18-4-7-23-8-5-18/h20H,2-9H2,1H3,(H,16,21,22)