2-[2-bromanyl-4-[[(4-chlorophenyl)amino]methyl]-6-ethoxy-phenoxy]-N-tert-butyl-ethanamide

Systemtic Name: 2-[2-bromanyl-4-[[(4-chlorophenyl)amino]methyl]-6-ethoxy-phenoxy]-N-tert-butyl-ethanamide Openeye Name: 2-[2-bromo-4-[(4-chloroanilino)methyl]-6-ethoxy-phenoxy]-N-tert-butyl-acetamide CAS Name: 2-[2-bromo-4-[(4-chloroanilino)methyl]-6-ethoxyphenoxy]-N-tert-butylacetamide IUPAC Name: 2-[2-bromo-4-[(4-chloroanilino)methyl]-6-ethoxyphenoxy]-N-tert-butylacetamide Traditional Name: 2-[2-bromo-4-[(4-chloroanilino)methyl]-6-ethoxy-phenoxy]-N-tert-butyl-acetamide Formula: C21H26BrClN2O3 MolecularWeight: 469.79974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2=CC=C(C=C2)Cl)Br)OCC(=O)NC(C)(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2=CC=C(C=C2)Cl)Br)OCC(=O)NC(C)(C)C

InChI

InChI=1S/C21H26BrClN2O3/c1-5-27-18-11-14(12-24-16-8-6-15(23)7-9-16)10-17(22)20(18)28-13-19(26)25-21(2,3)4/h6-11,24H,5,12-13H2,1-4H3,(H,25,26)