2-methylpropyl (2S)-2-[(3-chloranyl-4-fluoranyl-phenyl)-(phenylcarbonyl)amino]propanoate

Systemtic Name: 2-methylpropyl (2S)-2-[(3-chloranyl-4-fluoranyl-phenyl)-(phenylcarbonyl)amino]propanoate Openeye Name: isobutyl (2S)-2-(N-benzoyl-3-chloro-4-fluoro-anilino)propanoate CAS Name: (2S)-2-(N-benzoyl-3-chloro-4-fluoroanilino)propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2S)-2-(N-benzoyl-3-chloro-4-fluoroanilino)propanoate Traditional Name: (2S)-2-(N-benzoyl-3-chloro-4-fluoro-anilino)propionic acid isobutyl ester Formula: C20H21ClFNO3 MolecularWeight: 377.837043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C)N(C1=CC(=C(C=C1)F)Cl)C(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC(C)C)N(C1=CC(=C(C=C1)F)Cl)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H21ClFNO3/c1-13(2)12-26-20(25)14(3)23(16-9-10-18(22)17(21)11-16)19(24)15-7-5-4-6-8-15/h4-11,13-14H,12H2,1-3H3/t14-/m0/s1