[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(2,4-ditert-butylphenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(2,4-ditert-butylphenoxy)ethanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(2,4-ditert-butylphenoxy)acetate CAS Name: 2-(2,4-ditert-butylphenoxy)acetic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(2,4-ditert-butylphenoxy)acetate Traditional Name: 2-(2,4-ditert-butylphenoxy)acetic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO4/c1-8-11-22-18(23)13-26-19(24)14-25-17-10-9-15(20(2,3)4)12-16(17)21(5,6)7/h1,9-10,12H,11,13-14H2,2-7H3,(H,22,23)