2-(4-bromanylphenoxy)-2-methyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-2-methyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]propanamide Openeye Name: 2-(4-bromophenoxy)-2-methyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]propanamide CAS Name: 2-(4-bromophenoxy)-2-methyl-N-[4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]propanamide IUPAC Name: 2-(4-bromophenoxy)-2-methyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]propanamide Traditional Name: 2-(4-bromophenoxy)-2-methyl-N-[4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]propionamide Formula: C29H30BrN3O3 MolecularWeight: 548.4708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C=CC3=CC=CC=C3)OC4=CC=C(C=C4)Br

Isomeric SMILES

CC(C)(C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C29H30BrN3O3/c1-29(2,36-26-15-9-23(30)10-16-26)28(35)31-24-11-13-25(14-12-24)32-18-20-33(21-19-32)27(34)17-8-22-6-4-3-5-7-22/h3-17H,18-21H2,1-2H3,(H,31,35)/b17-8+