3-[2-(2-bromanyl-4-butan-2-yl-phenoxy)ethanoyl-(phenylmethyl)amino]propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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