6-[bis(cyanomethyl)amino]pyridine-3-carboxylic acid

Systemtic Name: 6-[bis(cyanomethyl)amino]pyridine-3-carboxylic acid Openeye Name: 6-[bis(cyanomethyl)amino]pyridine-3-carboxylic acid CAS Name: 6-[bis(cyanomethyl)amino]-3-pyridinecarboxylic acid IUPAC Name: 6-[bis(cyanomethyl)amino]pyridine-3-carboxylic acid Traditional Name: 6-[bis(cyanomethyl)amino]nicotinic acid Formula: C10H8N4O2 MolecularWeight: 216.19612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(=O)O)N(CC#N)CC#N

Isomeric SMILES

C1=CC(=NC=C1C(=O)O)N(CC#N)CC#N

InChI

InChI=1S/C10H8N4O2/c11-3-5-14(6-4-12)9-2-1-8(7-13-9)10(15)16/h1-2,7H,5-6H2,(H,15,16)