N-[[3-(4-bromophenyl)carbonyl-5-tert-butyl-2-oxidanyl-phenyl]methyl]-2-chloranyl-ethanamide

Systemtic Name: N-[[3-(4-bromophenyl)carbonyl-5-tert-butyl-2-oxidanyl-phenyl]methyl]-2-chloranyl-ethanamide Openeye Name: N-[[3-(4-bromobenzoyl)-5-tert-butyl-2-hydroxy-phenyl]methyl]-2-chloro-acetamide CAS Name: N-[[3-[(4-bromophenyl)-oxomethyl]-5-tert-butyl-2-hydroxyphenyl]methyl]-2-chloroacetamide IUPAC Name: N-[[3-(4-bromobenzoyl)-5-tert-butyl-2-hydroxyphenyl]methyl]-2-chloroacetamide Traditional Name: N-[3-(4-bromobenzoyl)-5-tert-butyl-2-hydroxy-benzyl]-2-chloro-acetamide Formula: C20H21BrClNO3 MolecularWeight: 438.74264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)O)CNC(=O)CCl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)O)CNC(=O)CCl

InChI

InChI=1S/C20H21BrClNO3/c1-20(2,3)14-8-13(11-23-17(24)10-22)19(26)16(9-14)18(25)12-4-6-15(21)7-5-12/h4-9,26H,10-11H2,1-3H3,(H,23,24)