5-heptyl-6-methyl-2-phenyl-1,3-diazinan-4-one

Systemtic Name: 5-heptyl-6-methyl-2-phenyl-1,3-diazinan-4-one Openeye Name: 5-heptyl-6-methyl-2-phenyl-hexahydropyrimidin-4-one CAS Name: 5-heptyl-6-methyl-2-phenyl-1,3-diazinan-4-one IUPAC Name: 5-heptyl-6-methyl-2-phenyl-1,3-diazinan-4-one Traditional Name: 5-heptyl-6-methyl-2-phenyl-hexahydropyrimidin-4-one Formula: C18H28N2O MolecularWeight: 288.42772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(NC(NC1=O)C2=CC=CC=C2)C

Isomeric SMILES

CCCCCCCC1C(NC(NC1=O)C2=CC=CC=C2)C

InChI

InChI=1S/C18H28N2O/c1-3-4-5-6-10-13-16-14(2)19-17(20-18(16)21)15-11-8-7-9-12-15/h7-9,11-12,14,16-17,19H,3-6,10,13H2,1-2H3,(H,20,21)