(2Z,4E,6E)-2-cyano-7-methyl-trideca-2,4,6-trienoic acid

Systemtic Name: (2Z,4E,6E)-2-cyano-7-methyl-trideca-2,4,6-trienoic acid Openeye Name: (2Z,4E,6E)-2-cyano-7-methyl-trideca-2,4,6-trienoic acid CAS Name: (2Z,4E,6E)-2-cyano-7-methyltrideca-2,4,6-trienoic acid IUPAC Name: (2Z,4E,6E)-2-cyano-7-methyltrideca-2,4,6-trienoic acid Traditional Name: (2Z,4E,6E)-2-cyano-7-methyl-trideca-2,4,6-trienoic acid Formula: C15H21NO2 MolecularWeight: 247.33274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=CC=CC=C(C#N)C(=O)O)C

Isomeric SMILES

CCCCCC/C(=C/C=C/C=C(/C#N)\C(=O)O)/C

InChI

InChI=1S/C15H21NO2/c1-3-4-5-6-9-13(2)10-7-8-11-14(12-16)15(17)18/h7-8,10-11H,3-6,9H2,1-2H3,(H,17,18)/b8-7+,13-10+,14-11-