[1-[1-(2,4-dichlorophenyl)ethylamino]-1-oxidanylidene-propan-2-yl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [1-[1-(2,4-dichlorophenyl)ethylamino]-1-oxidanylidene-propan-2-yl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-[1-(2,4-dichlorophenyl)ethylamino]-1-methyl-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [1-[1-(2,4-dichlorophenyl)ethylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[1-(2,4-dichlorophenyl)ethylamino]-1-oxopropan-2-yl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-[1-(2,4-dichlorophenyl)ethylamino]-2-keto-1-methyl-ethyl] ester Formula: C17H15BrCl2N2O3 MolecularWeight: 446.1226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Cl)Cl)NC(=O)C(C)OC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CC(C1=C(C=C(C=C1)Cl)Cl)NC(=O)C(C)OC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C17H15BrCl2N2O3/c1-9(14-4-3-13(19)6-15(14)20)22-16(23)10(2)25-17(24)11-5-12(18)8-21-7-11/h3-10H,1-2H3,(H,22,23)