[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 4-(3-bromanylphenoxy)butanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 4-(3-bromanylphenoxy)butanoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 4-(3-bromophenoxy)butanoate CAS Name: 4-(3-bromophenoxy)butanoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 4-(3-bromophenoxy)butanoate Traditional Name: 4-(3-bromophenoxy)butyric acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H19BrN2O5 MolecularWeight: 399.23646

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)CCCOC1=CC(=CC=C1)Br

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)CCCOC1=CC(=CC=C1)Br

InChI

InChI=1S/C16H19BrN2O5/c1-2-8-18-16(22)19-14(20)11-24-15(21)7-4-9-23-13-6-3-5-12(17)10-13/h2-3,5-6,10H,1,4,7-9,11H2,(H2,18,19,20,22)