2-[3-(cyanomethyl)-5-oxidanyl-1,3-diazinan-1-yl]ethanenitrile

Systemtic Name: 2-[3-(cyanomethyl)-5-oxidanyl-1,3-diazinan-1-yl]ethanenitrile Openeye Name: 2-[3-(cyanomethyl)-5-hydroxy-hexahydropyrimidin-1-yl]acetonitrile CAS Name: 2-[3-(cyanomethyl)-5-hydroxy-1,3-diazinan-1-yl]acetonitrile IUPAC Name: 2-[3-(cyanomethyl)-5-hydroxy-1,3-diazinan-1-yl]acetonitrile Traditional Name: 2-[3-(cyanomethyl)-5-hydroxy-hexahydropyrimidin-1-yl]acetonitrile Formula: C8H12N4O MolecularWeight: 180.20708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CN1CC#N)CC#N)O

Isomeric SMILES

C1C(CN(CN1CC#N)CC#N)O

InChI

InChI=1S/C8H12N4O/c9-1-3-11-5-8(13)6-12(7-11)4-2-10/h8,13H,3-7H2