(phenylmethyl) 2-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]ethanoate Openeye Name: benzyl 2-[[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]amino]acetate CAS Name: 2-[[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]amino]acetate Traditional Name: 2-[[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]amino]acetic acid benzyl ester Formula: C18H15BrFNO3 MolecularWeight: 392.219003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CNC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CNC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C18H15BrFNO3/c19-15-7-8-16(20)14(10-15)6-9-17(22)21-11-18(23)24-12-13-4-2-1-3-5-13/h1-10H,11-12H2,(H,21,22)/b9-6+