[2-[(E)-2-(2-acetyloxy-5-bromanyl-3-ethoxy-phenyl)ethenyl]quinolin-4-yl] ethanoate

Systemtic Name: [2-[(E)-2-(2-acetyloxy-5-bromanyl-3-ethoxy-phenyl)ethenyl]quinolin-4-yl] ethanoate Openeye Name: [2-[(E)-2-(2-acetoxy-5-bromo-3-ethoxy-phenyl)vinyl]-4-quinolyl] acetate CAS Name: acetic acid [2-[(E)-2-(2-acetyloxy-5-bromo-3-ethoxyphenyl)ethenyl]-4-quinolinyl] ester IUPAC Name: [2-[(E)-2-(2-acetyloxy-5-bromo-3-ethoxyphenyl)ethenyl]quinolin-4-yl] acetate Traditional Name: acetic acid [2-[(E)-2-(2-acetoxy-5-bromo-3-ethoxy-phenyl)vinyl]-4-quinolyl] ester Formula: C23H20BrNO5 MolecularWeight: 470.3126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)Br)C=CC2=NC3=CC=CC=C3C(=C2)OC(=O)C)OC(=O)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)Br)/C=C/C2=NC3=CC=CC=C3C(=C2)OC(=O)C)OC(=O)C

InChI

InChI=1S/C23H20BrNO5/c1-4-28-22-12-17(24)11-16(23(22)30-15(3)27)9-10-18-13-21(29-14(2)26)19-7-5-6-8-20(19)25-18/h5-13H,4H2,1-3H3/b10-9+