[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-2-phenoxybutanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-2-phenoxybutanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-2-phenoxybutanoate CAS Name: (2R)-2-phenoxybutanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-2-phenoxybutanoate Traditional Name: (2R)-2-phenoxybutyric acid [2-keto-2-(propargylamino)ethyl] ester Formula: C15H17NO4 MolecularWeight: 275.29978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC(=O)NCC#C)OC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C(=O)OCC(=O)NCC#C)OC1=CC=CC=C1

InChI

InChI=1S/C15H17NO4/c1-3-10-16-14(17)11-19-15(18)13(4-2)20-12-8-6-5-7-9-12/h1,5-9,13H,4,10-11H2,2H3,(H,16,17)/t13-/m1/s1