[2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] (2S)-2-(4-tert-butylphenoxy)propanoate

Systemtic Name: [2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] (2S)-2-(4-tert-butylphenoxy)propanoate Openeye Name: [2-(4-acetamido-2-fluoro-phenyl)-2-oxo-ethyl] (2S)-2-(4-tert-butylphenoxy)propanoate CAS Name: (2S)-2-(4-tert-butylphenoxy)propanoic acid [2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] (2S)-2-(4-tert-butylphenoxy)propanoate Traditional Name: (2S)-2-(4-tert-butylphenoxy)propionic acid [2-(4-acetamido-2-fluoro-phenyl)-2-keto-ethyl] ester Formula: C23H26FNO5 MolecularWeight: 415.454643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=C(C=C(C=C1)NC(=O)C)F)OC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)C1=C(C=C(C=C1)NC(=O)C)F)OC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H26FNO5/c1-14(30-18-9-6-16(7-10-18)23(3,4)5)22(28)29-13-21(27)19-11-8-17(12-20(19)24)25-15(2)26/h6-12,14H,13H2,1-5H3,(H,25,26)/t14-/m0/s1