[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 2-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 2-bromanylbenzoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H13BrN2O4 MolecularWeight: 341.15732

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1Br

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C13H13BrN2O4/c1-2-7-15-13(19)16-11(17)8-20-12(18)9-5-3-4-6-10(9)14/h2-6H,1,7-8H2,(H2,15,16,17,19)