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

Systemtic Name: 2-[4-[3-(3-butylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[3-(3-butylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[3-(3-butylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-N-phenylacetamide IUPAC Name: 2-[4-[3-(3-butylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-N-phenylacetamide Traditional Name: 2-[4-[3-(3-butylphenoxy)-2-hydroxy-propyl]piperazino]-N-phenyl-acetamide Formula: C25H35N3O3 MolecularWeight: 425.5637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC=C1)OCC(CN2CCN(CC2)CC(=O)NC3=CC=CC=C3)O

Isomeric SMILES

CCCCC1=CC(=CC=C1)OCC(CN2CCN(CC2)CC(=O)NC3=CC=CC=C3)O

InChI

InChI=1S/C25H35N3O3/c1-2-3-8-21-9-7-12-24(17-21)31-20-23(29)18-27-13-15-28(16-14-27)19-25(30)26-22-10-5-4-6-11-22/h4-7,9-12,17,23,29H,2-3,8,13-16,18-20H2,1H3,(H,26,30)