ethyl 4-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]amino]benzoic acid ethyl ester Formula: C18H15BrFNO3 MolecularWeight: 392.219003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C18H15BrFNO3/c1-2-24-18(23)12-3-7-15(8-4-12)21-17(22)10-5-13-11-14(19)6-9-16(13)20/h3-11H,2H2,1H3,(H,21,22)/b10-5+