[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(3-bromanylphenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(3-bromanylphenoxy)propanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-(3-bromophenoxy)propanoate CAS Name: 3-(3-bromophenoxy)propanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-(3-bromophenoxy)propanoate Traditional Name: 3-(3-bromophenoxy)propionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C14H14BrNO4 MolecularWeight: 340.16926

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)CCOC1=CC(=CC=C1)Br

Isomeric SMILES

C#CCNC(=O)COC(=O)CCOC1=CC(=CC=C1)Br

InChI

InChI=1S/C14H14BrNO4/c1-2-7-16-13(17)10-20-14(18)6-8-19-12-5-3-4-11(15)9-12/h1,3-5,9H,6-8,10H2,(H,16,17)