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

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 4-amino-3,5,6-trichloro-pyridine-2-carboxylate CAS Name: 4-amino-3,5,6-trichloro-2-pyridinecarboxylic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 4-amino-3,5,6-trichloropyridine-2-carboxylate Traditional Name: 4-amino-3,5,6-trichloro-picolinic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C18H16Cl3N3O3 MolecularWeight: 428.69694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)C3=NC(=C(C(=C3Cl)N)Cl)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)C3=NC(=C(C(=C3Cl)N)Cl)Cl

InChI

InChI=1S/C18H16Cl3N3O3/c19-12-14(22)13(20)16(21)23-15(12)18(26)27-9-10-3-5-11(6-4-10)17(25)24-7-1-2-8-24/h3-6H,1-2,7-9H2,(H2,22,23)