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

Systemtic Name: 2-[(2S,3R)-3-azanyl-4-(2-fluorophenyl)-2-methoxy-butyl]-N-tert-butyl-4-chloranyl-benzamide Openeye Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-methoxy-butyl]-N-tert-butyl-4-chloro-benzamide CAS Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-methoxybutyl]-N-tert-butyl-4-chlorobenzamide IUPAC Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-methoxybutyl]-N-tert-butyl-4-chlorobenzamide Traditional Name: 2-[(2S,3R)-3-amino-4-(2-fluorophenyl)-2-methoxy-butyl]-N-tert-butyl-4-chloro-benzamide Formula: C22H28ClFN2O2 MolecularWeight: 406.921323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClFN2O2/c1-22(2,3)26-21(27)17-10-9-16(23)11-15(17)13-20(28-4)19(25)12-14-7-5-6-8-18(14)24/h5-11,19-20H,12-13,25H2,1-4H3,(H,26,27)/t19-,20+/m1/s1