[4-bromanyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 4-fluoranylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 4-fluoranylbenzoate Openeye Name: [4-bromo-2-[(E)-3-(2-thienyl)prop-2-enoyl]phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-bromo-2-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-bromo-2-[(E)-3-(2-thienyl)acryloyl]phenyl] ester Formula: C20H12BrFO3S MolecularWeight: 431.274883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC(=O)C2=C(C=CC(=C2)Br)OC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CSC(=C1)/C=C/C(=O)C2=C(C=CC(=C2)Br)OC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H12BrFO3S/c21-14-5-10-19(25-20(24)13-3-6-15(22)7-4-13)17(12-14)18(23)9-8-16-2-1-11-26-16/h1-12H/b9-8+