3-bromanyl-4-ethoxy-5-methoxy-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-5-methoxy-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide Openeye Name: 3-bromo-4-ethoxy-5-methoxy-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide CAS Name: 3-bromo-4-ethoxy-5-methoxy-N-[1-[4-(1-oxopropylamino)phenyl]ethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-5-methoxy-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide Traditional Name: 3-bromo-4-ethoxy-5-methoxy-N-[1-(4-propionamidophenyl)ethyl]benzamide Formula: C21H25BrN2O4 MolecularWeight: 449.3382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN2O4/c1-5-19(25)24-16-9-7-14(8-10-16)13(3)23-21(26)15-11-17(22)20(28-6-2)18(12-15)27-4/h7-13H,5-6H2,1-4H3,(H,23,26)(H,24,25)