2-(4-bromanylphenoxy)-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-2-methyl-propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-2-methyl-propanamide Openeye Name: 2-(4-bromophenoxy)-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-2-methyl-propanamide CAS Name: 2-(4-bromophenoxy)-N-[3-methoxy-4-[(2-methyl-1-oxopropyl)amino]phenyl]-2-methylpropanamide IUPAC Name: 2-(4-bromophenoxy)-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-2-methylpropanamide Traditional Name: 2-(4-bromophenoxy)-N-[4-(isobutyrylamino)-3-methoxy-phenyl]-2-methyl-propionamide Formula: C21H25BrN2O4 MolecularWeight: 449.3382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=O)C(C)(C)OC2=CC=C(C=C2)Br)OC

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=O)C(C)(C)OC2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C21H25BrN2O4/c1-13(2)19(25)24-17-11-8-15(12-18(17)27-5)23-20(26)21(3,4)28-16-9-6-14(22)7-10-16/h6-13H,1-5H3,(H,23,26)(H,24,25)