[1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl] 5-bromanylpyridine-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2,4,6-trimethylanilino)ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (2-keto-2-mesidino-1-methyl-ethyl) ester Formula: C18H19BrN2O3 MolecularWeight: 391.25906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(C)OC(=O)C2=CC(=CN=C2)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C(C)OC(=O)C2=CC(=CN=C2)Br)C

InChI

InChI=1S/C18H19BrN2O3/c1-10-5-11(2)16(12(3)6-10)21-17(22)13(4)24-18(23)14-7-15(19)9-20-8-14/h5-9,13H,1-4H3,(H,21,22)