6-bromanyl-2-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]quinoline-4-carboxylate

Systemtic Name: 6-bromanyl-2-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]quinoline-4-carboxylate Openeye Name: 6-bromo-2-[(E)-2-[3-(trifluoromethyl)phenyl]vinyl]quinoline-4-carboxylate CAS Name: 6-bromo-2-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]-4-quinolinecarboxylate IUPAC Name: 6-bromo-2-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]quinoline-4-carboxylate Traditional Name: 6-bromo-2-[(E)-2-[3-(trifluoromethyl)phenyl]vinyl]cinchoninate Formula: C19H10BrF3NO2- MolecularWeight: 421.18741

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C=CC2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)/C=C/C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-]

InChI

InChI=1S/C19H11BrF3NO2/c20-13-5-7-17-15(9-13)16(18(25)26)10-14(24-17)6-4-11-2-1-3-12(8-11)19(21,22)23/h1-10H,(H,25,26)/p-1/b6-4+