2-[(2S,3R)-3-azanyl-4-(2-fluorophenyl)-2-oxidanyl-butyl]-N-tert-butyl-5-chloranyl-benzamide

Systemtic Name: 2-[(2S,3R)-3-azanyl-4-(2-fluorophenyl)-2-oxidanyl-butyl]-N-tert-butyl-5-chloranyl-benzamide Openeye Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-hydroxy-butyl]-N-tert-butyl-5-chloro-benzamide CAS Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-hydroxybutyl]-N-tert-butyl-5-chlorobenzamide IUPAC Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-hydroxybutyl]-N-tert-butyl-5-chlorobenzamide Traditional Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-hydroxy-butyl]-N-tert-butyl-5-chloro-benzamide Formula: C21H26ClFN2O2 MolecularWeight: 392.894743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=C(C=CC(=C1)Cl)CC(C(CC2=CC=CC=C2F)N)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C=CC(=C1)Cl)C[C@@H]([C@@H](CC2=CC=CC=C2F)N)O

InChI

InChI=1S/C21H26ClFN2O2/c1-21(2,3)25-20(27)16-12-15(22)9-8-13(16)11-19(26)18(24)10-14-6-4-5-7-17(14)23/h4-9,12,18-19,26H,10-11,24H2,1-3H3,(H,25,27)/t18-,19+/m1/s1