7-[(3-cyanopyridin-2-yl)amino]heptanoate

Systemtic Name: 7-[(3-cyanopyridin-2-yl)amino]heptanoate Openeye Name: 7-[(3-cyano-2-pyridyl)amino]heptanoate CAS Name: 7-[(3-cyano-2-pyridinyl)amino]heptanoate IUPAC Name: 7-[(3-cyanopyridin-2-yl)amino]heptanoate Traditional Name: 7-[(3-cyano-2-pyridyl)amino]enanthate Formula: C13H16N3O2- MolecularWeight: 246.28504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NCCCCCCC(=O)[O-])C#N

Isomeric SMILES

C1=CC(=C(N=C1)NCCCCCCC(=O)[O-])C#N

InChI

InChI=1S/C13H17N3O2/c14-10-11-6-5-9-16-13(11)15-8-4-2-1-3-7-12(17)18/h5-6,9H,1-4,7-8H2,(H,15,16)(H,17,18)/p-1