[2-[1-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-[1-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-[1-(3-chlorophenyl)ethylamino]-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-[1-(3-chlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(3-chlorophenyl)ethylamino]-2-oxoethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-[1-(3-chlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C16H14BrClN2O3 MolecularWeight: 397.65096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Cl)NC(=O)COC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CC(C1=CC(=CC=C1)Cl)NC(=O)COC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C16H14BrClN2O3/c1-10(11-3-2-4-14(18)6-11)20-15(21)9-23-16(22)12-5-13(17)8-19-7-12/h2-8,10H,9H2,1H3,(H,20,21)