[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(4-bromophenyl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(4-bromophenyl)ethanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(4-bromophenyl)acetate CAS Name: 2-(4-bromophenyl)acetic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(4-bromophenyl)acetate Traditional Name: 2-(4-bromophenyl)acetic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C13H12BrNO3 MolecularWeight: 310.14328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)CC1=CC=C(C=C1)Br

Isomeric SMILES

C#CCNC(=O)COC(=O)CC1=CC=C(C=C1)Br

InChI

InChI=1S/C13H12BrNO3/c1-2-7-15-12(16)9-18-13(17)8-10-3-5-11(14)6-4-10/h1,3-6H,7-9H2,(H,15,16)