[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(4-ethylphenyl)propanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(4-ethylphenyl)propanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-(4-ethylphenyl)propanoate CAS Name: 3-(4-ethylphenyl)propanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-(4-ethylphenyl)propanoate Traditional Name: 3-(4-ethylphenyl)propionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCC(=O)OCC(=O)NCC#C

Isomeric SMILES

CCC1=CC=C(C=C1)CCC(=O)OCC(=O)NCC#C

InChI

InChI=1S/C16H19NO3/c1-3-11-17-15(18)12-20-16(19)10-9-14-7-5-13(4-2)6-8-14/h1,5-8H,4,9-12H2,2H3,(H,17,18)