[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2,4-di(propan-2-yl)benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2,4-di(propan-2-yl)benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2,4-diisopropylbenzoate CAS Name: 2,4-di(propan-2-yl)benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2,4-di(propan-2-yl)benzoate Traditional Name: 2,4-diisopropylbenzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO3/c1-6-9-19-17(20)11-22-18(21)15-8-7-14(12(2)3)10-16(15)13(4)5/h1,7-8,10,12-13H,9,11H2,2-5H3,(H,19,20)