tert-butyl 2-[bis(bromanyl)methyl]-6-chloranyl-quinoline-4-carboxylate

Systemtic Name: tert-butyl 2-[bis(bromanyl)methyl]-6-chloranyl-quinoline-4-carboxylate Openeye Name: tert-butyl 6-chloro-2-(dibromomethyl)quinoline-4-carboxylate CAS Name: 6-chloro-2-(dibromomethyl)-4-quinolinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-chloro-2-(dibromomethyl)quinoline-4-carboxylate Traditional Name: 6-chloro-2-(dibromomethyl)cinchoninic acid tert-butyl ester Formula: C15H14Br2ClNO2 MolecularWeight: 435.53816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=NC2=C1C=C(C=C2)Cl)C(Br)Br

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=NC2=C1C=C(C=C2)Cl)C(Br)Br

InChI

InChI=1S/C15H14Br2ClNO2/c1-15(2,3)21-14(20)10-7-12(13(16)17)19-11-5-4-8(18)6-9(10)11/h4-7,13H,1-3H3