[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-2-(4-tert-butylphenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-2-(4-tert-butylphenoxy)propanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-2-(4-tert-butylphenoxy)propanoate CAS Name: (2R)-2-(4-tert-butylphenoxy)propanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-2-(4-tert-butylphenoxy)propanoate Traditional Name: (2R)-2-(4-tert-butylphenoxy)propionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO4/c1-6-11-19-16(20)12-22-17(21)13(2)23-15-9-7-14(8-10-15)18(3,4)5/h1,7-10,13H,11-12H2,2-5H3,(H,19,20)/t13-/m1/s1