[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl] 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: [2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl] 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate Openeye Name: [2-(2-fluoroanilino)-2-oxo-ethyl] 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoate CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid [2-(2-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-fluoroanilino)-2-oxoethyl] 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propionic acid [2-(2-fluoroanilino)-2-keto-ethyl] ester Formula: C25H32FNO4 MolecularWeight: 429.524283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OCC(=O)NC2=CC=CC=C2F

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OCC(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C25H32FNO4/c1-24(2,3)17-13-16(14-18(23(17)30)25(4,5)6)11-12-22(29)31-15-21(28)27-20-10-8-7-9-19(20)26/h7-10,13-14,30H,11-12,15H2,1-6H3,(H,27,28)