2-[4-[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[3-(4-bromophenoxy)-2-hydroxy-propyl]piperazin-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[3-(4-bromophenoxy)-2-hydroxypropyl]-1-piperazinyl]-N-phenylacetamide IUPAC Name: 2-[4-[3-(4-bromophenoxy)-2-hydroxypropyl]piperazin-1-yl]-N-phenylacetamide Traditional Name: 2-[4-[3-(4-bromophenoxy)-2-hydroxy-propyl]piperazino]-N-phenyl-acetamide Formula: C21H26BrN3O3 MolecularWeight: 448.35344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)Br)O)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)Br)O)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H26BrN3O3/c22-17-6-8-20(9-7-17)28-16-19(26)14-24-10-12-25(13-11-24)15-21(27)23-18-4-2-1-3-5-18/h1-9,19,26H,10-16H2,(H,23,27)