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

Systemtic Name: [1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: (1-methyl-2-oxo-2-ureido-ethyl) (E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-propenoic acid [1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-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-keto-1-methyl-2-ureido-ethyl) ester Formula: C13H12BrFN2O4 MolecularWeight: 359.147783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)OC(=O)C=CC1=C(C=CC(=C1)Br)F

Isomeric SMILES

CC(C(=O)NC(=O)N)OC(=O)/C=C/C1=C(C=CC(=C1)Br)F

InChI

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