[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C15H13BrN2O3 MolecularWeight: 349.17932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C15H13BrN2O3/c16-13-6-12(8-17-9-13)15(20)21-10-14(19)18-7-11-4-2-1-3-5-11/h1-6,8-9H,7,10H2,(H,18,19)