(3E)-3-(pyridin-2-ylmethylidene)octan-2-ol

Systemtic Name: (3E)-3-(pyridin-2-ylmethylidene)octan-2-ol Openeye Name: (3E)-3-(2-pyridylmethylene)octan-2-ol CAS Name: (3E)-3-(2-pyridinylmethylidene)-2-octanol IUPAC Name: (3E)-3-(pyridin-2-ylmethylidene)octan-2-ol Traditional Name: (E)-3-amyl-4-(2-pyridyl)but-3-en-2-ol Formula: C14H21NO MolecularWeight: 219.32264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC1=CC=CC=N1)C(C)O

Isomeric SMILES

CCCCC/C(=C\C1=CC=CC=N1)/C(C)O

InChI

InChI=1S/C14H21NO/c1-3-4-5-8-13(12(2)16)11-14-9-6-7-10-15-14/h6-7,9-12,16H,3-5,8H2,1-2H3/b13-11+