2-(4-bromanylphenoxy)-N-[4-(butanoylamino)-3-chloranyl-phenyl]-2-methyl-propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[4-(butanoylamino)-3-chloranyl-phenyl]-2-methyl-propanamide Openeye Name: 2-(4-bromophenoxy)-N-[4-(butanoylamino)-3-chloro-phenyl]-2-methyl-propanamide CAS Name: 2-(4-bromophenoxy)-N-[3-chloro-4-(1-oxobutylamino)phenyl]-2-methylpropanamide IUPAC Name: 2-(4-bromophenoxy)-N-[4-(butanoylamino)-3-chlorophenyl]-2-methylpropanamide Traditional Name: 2-(4-bromophenoxy)-N-(4-butyramido-3-chloro-phenyl)-2-methyl-propionamide Formula: C20H22BrClN2O3 MolecularWeight: 453.75728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrClN2O3/c1-4-5-18(25)24-17-11-8-14(12-16(17)22)23-19(26)20(2,3)27-15-9-6-13(21)7-10-15/h6-12H,4-5H2,1-3H3,(H,23,26)(H,24,25)