[2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-chloranylpyridine-4-carboxylate Openeye Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxo-ethyl] 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid [2-[1-(4-bromophenyl)ethylamino]-2-keto-ethyl] ester Formula: C16H14BrClN2O3 MolecularWeight: 397.65096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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