4-[3-(3-bromanylphenoxy)-2-oxidanyl-propyl]piperazin-2-one

Systemtic Name: 4-[3-(3-bromanylphenoxy)-2-oxidanyl-propyl]piperazin-2-one Openeye Name: 4-[3-(3-bromophenoxy)-2-hydroxy-propyl]piperazin-2-one CAS Name: 4-[3-(3-bromophenoxy)-2-hydroxypropyl]-2-piperazinone IUPAC Name: 4-[3-(3-bromophenoxy)-2-hydroxypropyl]piperazin-2-one Traditional Name: 4-[3-(3-bromophenoxy)-2-hydroxy-propyl]piperazin-2-one Formula: C13H17BrN2O3 MolecularWeight: 329.18968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)CC(COC2=CC(=CC=C2)Br)O

Isomeric SMILES

C1CN(CC(=O)N1)CC(COC2=CC(=CC=C2)Br)O

InChI

InChI=1S/C13H17BrN2O3/c14-10-2-1-3-12(6-10)19-9-11(17)7-16-5-4-15-13(18)8-16/h1-3,6,11,17H,4-5,7-9H2,(H,15,18)