ethyl 2-bromanyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline-4-carboxylate

Systemtic Name: ethyl 2-bromanyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline-4-carboxylate Openeye Name: ethyl 2-bromo-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline-4-carboxylate CAS Name: 2-bromo-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-bromo-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline-4-carboxylate Traditional Name: 2-bromo-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cinchoninic acid ethyl ester Formula: C18H21BBrNO4 MolecularWeight: 406.07864

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC(C(O1)(C)C)(C)C)C2=C(C3=CC=CC=C3N=C2Br)C(=O)OCC

Isomeric SMILES

B1(OC(C(O1)(C)C)(C)C)C2=C(C3=CC=CC=C3N=C2Br)C(=O)OCC

InChI

InChI=1S/C18H21BBrNO4/c1-6-23-16(22)13-11-9-7-8-10-12(11)21-15(20)14(13)19-24-17(2,3)18(4,5)25-19/h7-10H,6H2,1-5H3