N-[3-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]-2-methyl-phenyl]propanamide

Systemtic Name: N-[3-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]-2-methyl-phenyl]propanamide Openeye Name: N-[3-[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]-2-methyl-phenyl]propanamide CAS Name: N-[3-[[2-(2-bromo-4-tert-butylphenoxy)-1-oxoethyl]amino]-2-methylphenyl]propanamide IUPAC Name: N-[3-[[2-(2-bromo-4-tert-butylphenoxy)acetyl]amino]-2-methylphenyl]propanamide Traditional Name: N-[3-[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]-2-methyl-phenyl]propionamide Formula: C22H27BrN2O3 MolecularWeight: 447.36538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=CC=C1)NC(=O)COC2=C(C=C(C=C2)C(C)(C)C)Br)C

Isomeric SMILES

CCC(=O)NC1=C(C(=CC=C1)NC(=O)COC2=C(C=C(C=C2)C(C)(C)C)Br)C

InChI

InChI=1S/C22H27BrN2O3/c1-6-20(26)24-17-8-7-9-18(14(17)2)25-21(27)13-28-19-11-10-15(12-16(19)23)22(3,4)5/h7-12H,6,13H2,1-5H3,(H,24,26)(H,25,27)