(1-cyanoindolizin-2-yl)methyl 2-chloranylpyridine-3-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-chloranylpyridine-3-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C16H10ClN3O2 MolecularWeight: 311.7225

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10ClN3O2/c17-15-12(4-3-6-19-15)16(21)22-10-11-9-20-7-2-1-5-14(20)13(11)8-18/h1-7,9H,10H2