[1-oxidanylidene-1-(propylamino)propan-2-yl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 5-bromanylpyridine-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C12H15BrN2O3 MolecularWeight: 315.1631

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC(=CN=C1)Br

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=CC(=CN=C1)Br

InChI

InChI=1S/C12H15BrN2O3/c1-3-4-15-11(16)8(2)18-12(17)9-5-10(13)7-14-6-9/h5-8H,3-4H2,1-2H3,(H,15,16)