[4-(propanoylamino)phenyl] 5-bromanyl-2-ethoxy-benzoate

Systemtic Name: [4-(propanoylamino)phenyl] 5-bromanyl-2-ethoxy-benzoate Openeye Name: [4-(propanoylamino)phenyl] 5-bromo-2-ethoxy-benzoate CAS Name: 5-bromo-2-ethoxybenzoic acid [4-(1-oxopropylamino)phenyl] ester IUPAC Name: [4-(propanoylamino)phenyl] 5-bromo-2-ethoxybenzoate Traditional Name: 5-bromo-2-ethoxy-benzoic acid (4-propionamidophenyl) ester Formula: C18H18BrNO4 MolecularWeight: 392.24382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrNO4/c1-3-17(21)20-13-6-8-14(9-7-13)24-18(22)15-11-12(19)5-10-16(15)23-4-2/h5-11H,3-4H2,1-2H3,(H,20,21)