[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] (E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-propenoic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)acrylic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C13H12BrFN2O4 MolecularWeight: 359.147783

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)COC(=O)C=CC1=C(C=CC(=C1)Br)F

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrFN2O4/c1-16-13(20)17-11(18)7-21-12(19)5-2-8-6-9(14)3-4-10(8)15/h2-6H,7H2,1H3,(H2,16,17,18,20)/b5-2+