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

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-bromanylbenzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C12H10BrNO3 MolecularWeight: 296.1167

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10BrNO3/c1-2-7-14-11(15)8-17-12(16)9-5-3-4-6-10(9)13/h1,3-6H,7-8H2,(H,14,15)