3-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]propanamide CAS Name: 3-[[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]propanamide Traditional Name: 3-[benzyl-[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]propionamide Formula: C22H27BrN2O3 MolecularWeight: 447.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)N(CCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)N(CCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C22H27BrN2O3/c1-22(2,3)18-13-17(23)9-10-19(18)28-15-21(27)25(12-11-20(24)26)14-16-7-5-4-6-8-16/h4-10,13H,11-12,14-15H2,1-3H3,(H2,24,26)