3-bromanyl-N-[5-(butanoylamino)-2-chloranyl-phenyl]-4-butoxy-benzamide

Systemtic Name: 3-bromanyl-N-[5-(butanoylamino)-2-chloranyl-phenyl]-4-butoxy-benzamide Openeye Name: 3-bromo-N-[5-(butanoylamino)-2-chloro-phenyl]-4-butoxy-benzamide CAS Name: 3-bromo-4-butoxy-N-[2-chloro-5-(1-oxobutylamino)phenyl]benzamide IUPAC Name: 3-bromo-N-[5-(butanoylamino)-2-chlorophenyl]-4-butoxybenzamide Traditional Name: 3-bromo-4-butoxy-N-(5-butyramido-2-chloro-phenyl)benzamide Formula: C21H24BrClN2O3 MolecularWeight: 467.78386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)CCC)Cl)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)CCC)Cl)Br

InChI

InChI=1S/C21H24BrClN2O3/c1-3-5-11-28-19-10-7-14(12-16(19)22)21(27)25-18-13-15(8-9-17(18)23)24-20(26)6-4-2/h7-10,12-13H,3-6,11H2,1-2H3,(H,24,26)(H,25,27)