7-[(4-cyanopyridin-2-yl)amino]heptanoic acid

Systemtic Name: 7-[(4-cyanopyridin-2-yl)amino]heptanoic acid Openeye Name: 7-[(4-cyano-2-pyridyl)amino]heptanoic acid CAS Name: 7-[(4-cyano-2-pyridinyl)amino]heptanoic acid IUPAC Name: 7-[(4-cyanopyridin-2-yl)amino]heptanoic acid Traditional Name: 7-[(4-cyano-2-pyridyl)amino]enanthic acid Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=C1C#N)NCCCCCCC(=O)O

Isomeric SMILES

C1=CN=C(C=C1C#N)NCCCCCCC(=O)O

InChI

InChI=1S/C13H17N3O2/c14-10-11-6-8-16-12(9-11)15-7-4-2-1-3-5-13(17)18/h6,8-9H,1-5,7H2,(H,15,16)(H,17,18)