[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: [2-(benzylamino)-1-methyl-2-oxo-ethyl] (E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-propenoic acid [1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: [1-(benzylamino)-1-oxopropan-2-yl] (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)acrylic acid [2-(benzylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H17BrFNO3 MolecularWeight: 406.245583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)OC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)OC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C19H17BrFNO3/c1-13(19(24)22-12-14-5-3-2-4-6-14)25-18(23)10-7-15-11-16(20)8-9-17(15)21/h2-11,13H,12H2,1H3,(H,22,24)/b10-7+