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

Systemtic Name: [1-[(2-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: [2-(2-acetylanilino)-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-(2-acetylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-acetylanilino)-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-(2-acetylanilino)-2-keto-1-methyl-ethyl] ester Formula: C20H17BrFNO4 MolecularWeight: 434.255683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)C)OC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(=O)C)OC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C20H17BrFNO4/c1-12(24)16-5-3-4-6-18(16)23-20(26)13(2)27-19(25)10-7-14-11-15(21)8-9-17(14)22/h3-11,13H,1-2H3,(H,23,26)/b10-7+