(2S)-6-bromanyl-3,3-diethyl-2-oxidanyl-1,2-dihydropyridine-4,4,5-tricarbonitrile

Systemtic Name: (2S)-6-bromanyl-3,3-diethyl-2-oxidanyl-1,2-dihydropyridine-4,4,5-tricarbonitrile Openeye Name: (2S)-6-bromo-3,3-diethyl-2-hydroxy-1,2-dihydropyridine-4,4,5-tricarbonitrile CAS Name: (2S)-6-bromo-3,3-diethyl-2-hydroxy-1,2-dihydropyridine-4,4,5-tricarbonitrile IUPAC Name: (2S)-6-bromo-3,3-diethyl-2-hydroxy-1,2-dihydropyridine-4,4,5-tricarbonitrile Traditional Name: (2S)-6-bromo-3,3-diethyl-2-hydroxy-1,2-dihydropyridine-4,4,5-tricarbonitrile Formula: C12H13BrN4O MolecularWeight: 309.16182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(NC(=C(C1(C#N)C#N)C#N)Br)O)CC

Isomeric SMILES

CCC1([C@@H](NC(=C(C1(C#N)C#N)C#N)Br)O)CC

InChI

InChI=1S/C12H13BrN4O/c1-3-11(4-2)10(18)17-9(13)8(5-14)12(11,6-15)7-16/h10,17-18H,3-4H2,1-2H3/t10-/m0/s1