1-(3-bromanyl-1,2-oxazol-5-yl)-2-[6-(6-pyridin-2-ylhexoxy)hexylamino]ethanol

Systemtic Name: 1-(3-bromanyl-1,2-oxazol-5-yl)-2-[6-(6-pyridin-2-ylhexoxy)hexylamino]ethanol Openeye Name: 1-(3-bromoisoxazol-5-yl)-2-[6-[6-(2-pyridyl)hexoxy]hexylamino]ethanol CAS Name: 1-(3-bromo-5-isoxazolyl)-2-[6-[6-(2-pyridinyl)hexoxy]hexylamino]ethanol IUPAC Name: 1-(3-bromo-1,2-oxazol-5-yl)-2-[6-(6-pyridin-2-ylhexoxy)hexylamino]ethanol Traditional Name: 1-(3-bromoisoxazol-5-yl)-2-[6-[6-(2-pyridyl)hexoxy]hexylamino]ethanol Formula: C22H34BrN3O3 MolecularWeight: 468.42766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCCCCCOCCCCCCNCC(C2=CC(=NO2)Br)O

Isomeric SMILES

C1=CC=NC(=C1)CCCCCCOCCCCCCNCC(C2=CC(=NO2)Br)O

InChI

InChI=1S/C22H34BrN3O3/c23-22-17-21(29-26-22)20(27)18-24-13-7-2-4-10-16-28-15-9-3-1-5-11-19-12-6-8-14-25-19/h6,8,12,14,17,20,24,27H,1-5,7,9-11,13,15-16,18H2