hexyl (2S)-2-[(3-fluorophenyl)carbonylamino]propanoate

Systemtic Name: hexyl (2S)-2-[(3-fluorophenyl)carbonylamino]propanoate Openeye Name: hexyl (2S)-2-[(3-fluorobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(3-fluorophenyl)-oxomethyl]amino]propanoic acid hexyl ester IUPAC Name: hexyl (2S)-2-[(3-fluorobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(3-fluorobenzoyl)amino]propionic acid hexyl ester Formula: C16H22FNO3 MolecularWeight: 295.349183

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(C)NC(=O)C1=CC(=CC=C1)F

Isomeric SMILES

CCCCCCOC(=O)[C@H](C)NC(=O)C1=CC(=CC=C1)F

InChI

InChI=1S/C16H22FNO3/c1-3-4-5-6-10-21-16(20)12(2)18-15(19)13-8-7-9-14(17)11-13/h7-9,11-12H,3-6,10H2,1-2H3,(H,18,19)/t12-/m0/s1