methyl (4S)-5-(4-methylphenyl)-4-[2,2,2-tris(fluoranyl)ethanoylamino]pentanoate

Systemtic Name: methyl (4S)-5-(4-methylphenyl)-4-[2,2,2-tris(fluoranyl)ethanoylamino]pentanoate Openeye Name: methyl (4S)-5-(p-tolyl)-4-[(2,2,2-trifluoroacetyl)amino]pentanoate CAS Name: (4S)-5-(4-methylphenyl)-4-[(2,2,2-trifluoro-1-oxoethyl)amino]pentanoic acid methyl ester IUPAC Name: methyl (4S)-5-(4-methylphenyl)-4-[(2,2,2-trifluoroacetyl)amino]pentanoate Traditional Name: (4S)-5-(p-tolyl)-4-[(2,2,2-trifluoroacetyl)amino]valeric acid methyl ester Formula: C15H18F3NO3 MolecularWeight: 317.30353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(CCC(=O)OC)NC(=O)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C[C@H](CCC(=O)OC)NC(=O)C(F)(F)F

InChI

InChI=1S/C15H18F3NO3/c1-10-3-5-11(6-4-10)9-12(7-8-13(20)22-2)19-14(21)15(16,17)18/h3-6,12H,7-9H2,1-2H3,(H,19,21)/t12-/m0/s1