(1-cyanoindolizin-2-yl)methyl 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 4-amino-3,5,6-trichloro-pyridine-2-carboxylate CAS Name: 4-amino-3,5,6-trichloro-2-pyridinecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 4-amino-3,5,6-trichloropyridine-2-carboxylate Traditional Name: 4-amino-3,5,6-trichloro-picolinic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C16H9Cl3N4O2 MolecularWeight: 395.62726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN2C=C1)COC(=O)C3=NC(=C(C(=C3Cl)N)Cl)Cl)C#N

Isomeric SMILES

C1=CC2=C(C(=CN2C=C1)COC(=O)C3=NC(=C(C(=C3Cl)N)Cl)Cl)C#N

InChI

InChI=1S/C16H9Cl3N4O2/c17-11-13(21)12(18)15(19)22-14(11)16(24)25-7-8-6-23-4-2-1-3-10(23)9(8)5-20/h1-4,6H,7H2,(H2,21,22)