(2S)-2-acetamido-N-(4-chloranyl-2-fluoranyl-phenyl)-3-methyl-butanamide

Systemtic Name: (2S)-2-acetamido-N-(4-chloranyl-2-fluoranyl-phenyl)-3-methyl-butanamide Openeye Name: (2S)-2-acetamido-N-(4-chloro-2-fluoro-phenyl)-3-methyl-butanamide CAS Name: (2S)-2-acetamido-N-(4-chloro-2-fluorophenyl)-3-methylbutanamide IUPAC Name: (2S)-2-acetamido-N-(4-chloro-2-fluorophenyl)-3-methylbutanamide Traditional Name: (2S)-2-acetamido-N-(4-chloro-2-fluoro-phenyl)-3-methyl-butyramide Formula: C13H16ClFN2O2 MolecularWeight: 286.729743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=C(C=C1)Cl)F)NC(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=C(C=C(C=C1)Cl)F)NC(=O)C

InChI

InChI=1S/C13H16ClFN2O2/c1-7(2)12(16-8(3)18)13(19)17-11-5-4-9(14)6-10(11)15/h4-7,12H,1-3H3,(H,16,18)(H,17,19)/t12-/m0/s1