[4-[(E)-2-(8-acetyloxyquinolin-2-yl)ethenyl]-2-bromanyl-phenyl] ethanoate

Systemtic Name: [4-[(E)-2-(8-acetyloxyquinolin-2-yl)ethenyl]-2-bromanyl-phenyl] ethanoate Openeye Name: [4-[(E)-2-(8-acetoxy-2-quinolyl)vinyl]-2-bromo-phenyl] acetate CAS Name: acetic acid [4-[(E)-2-(8-acetyloxy-2-quinolinyl)ethenyl]-2-bromophenyl] ester IUPAC Name: [4-[(E)-2-(8-acetyloxyquinolin-2-yl)ethenyl]-2-bromophenyl] acetate Traditional Name: acetic acid [4-[(E)-2-(8-acetoxy-2-quinolyl)vinyl]-2-bromo-phenyl] ester Formula: C21H16BrNO4 MolecularWeight: 426.26004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=CC2=NC3=C(C=CC=C3OC(=O)C)C=C2)Br

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)/C=C/C2=NC3=C(C=CC=C3OC(=O)C)C=C2)Br

InChI

InChI=1S/C21H16BrNO4/c1-13(24)26-19-11-7-15(12-18(19)22)6-9-17-10-8-16-4-3-5-20(21(16)23-17)27-14(2)25/h3-12H,1-2H3/b9-6+