[2-bromanyl-6-ethoxy-4-[(E)-2-quinolin-2-ylethenyl]phenyl] ethanoate

Systemtic Name: [2-bromanyl-6-ethoxy-4-[(E)-2-quinolin-2-ylethenyl]phenyl] ethanoate Openeye Name: [2-bromo-6-ethoxy-4-[(E)-2-(2-quinolyl)vinyl]phenyl] acetate CAS Name: acetic acid [2-bromo-6-ethoxy-4-[(E)-2-(2-quinolinyl)ethenyl]phenyl] ester IUPAC Name: [2-bromo-6-ethoxy-4-[(E)-2-quinolin-2-ylethenyl]phenyl] acetate Traditional Name: acetic acid [2-bromo-6-ethoxy-4-[(E)-2-(2-quinolyl)vinyl]phenyl] ester Formula: C21H18BrNO3 MolecularWeight: 412.27652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrNO3/c1-3-25-20-13-15(12-18(22)21(20)26-14(2)24)8-10-17-11-9-16-6-4-5-7-19(16)23-17/h4-13H,3H2,1-2H3/b10-8+