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

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (2R)-2-(4-tert-butylphenoxy)propanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] (2R)-2-(4-tert-butylphenoxy)propanoate CAS Name: (2R)-2-(4-tert-butylphenoxy)propanoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] (2R)-2-(4-tert-butylphenoxy)propanoate Traditional Name: (2R)-2-(4-tert-butylphenoxy)propionic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NCCC#N)OC1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O4/c1-13(17(22)23-12-16(21)20-11-5-10-19)24-15-8-6-14(7-9-15)18(2,3)4/h6-9,13H,5,11-12H2,1-4H3,(H,20,21)/t13-/m1/s1