[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H13BrN2O5 MolecularWeight: 357.15672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrN2O5/c1-2-5-15-13(20)16-11(18)7-21-12(19)9-6-8(14)3-4-10(9)17/h2-4,6,17H,1,5,7H2,(H2,15,16,18,20)