(4-bromanyl-2-fluoranyl-phenyl) 3-[(4-tert-butylphenyl)carbonylamino]propanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl) 3-[(4-tert-butylphenyl)carbonylamino]propanoate Openeye Name: (4-bromo-2-fluoro-phenyl) 3-[(4-tert-butylbenzoyl)amino]propanoate CAS Name: 3-[[(4-tert-butylphenyl)-oxomethyl]amino]propanoic acid (4-bromo-2-fluorophenyl) ester IUPAC Name: (4-bromo-2-fluorophenyl) 3-[(4-tert-butylbenzoyl)amino]propanoate Traditional Name: 3-[(4-tert-butylbenzoyl)amino]propionic acid (4-bromo-2-fluoro-phenyl) ester Formula: C20H21BrFNO3 MolecularWeight: 422.288043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)OC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)OC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C20H21BrFNO3/c1-20(2,3)14-6-4-13(5-7-14)19(25)23-11-10-18(24)26-17-9-8-15(21)12-16(17)22/h4-9,12H,10-11H2,1-3H3,(H,23,25)