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

Systemtic Name: 5-bromanyl-N-[4-(butanoylamino)phenyl]-2-butoxy-benzamide Openeye Name: 5-bromo-N-[4-(butanoylamino)phenyl]-2-butoxy-benzamide CAS Name: 5-bromo-2-butoxy-N-[4-(1-oxobutylamino)phenyl]benzamide IUPAC Name: 5-bromo-N-[4-(butanoylamino)phenyl]-2-butoxybenzamide Traditional Name: 5-bromo-2-butoxy-N-(4-butyramidophenyl)benzamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN2O3/c1-3-5-13-27-19-12-7-15(22)14-18(19)21(26)24-17-10-8-16(9-11-17)23-20(25)6-4-2/h7-12,14H,3-6,13H2,1-2H3,(H,23,25)(H,24,26)