2-(hydroxymethyl)-4-[1-oxidanyl-2-[6-(6-pyridin-2-ylhexoxy)hexylamino]ethyl]phenol

Systemtic Name: 2-(hydroxymethyl)-4-[1-oxidanyl-2-[6-(6-pyridin-2-ylhexoxy)hexylamino]ethyl]phenol Openeye Name: 2-(hydroxymethyl)-4-[1-hydroxy-2-[6-[6-(2-pyridyl)hexoxy]hexylamino]ethyl]phenol CAS Name: 2-(hydroxymethyl)-4-[1-hydroxy-2-[6-[6-(2-pyridinyl)hexoxy]hexylamino]ethyl]phenol IUPAC Name: 2-(hydroxymethyl)-4-[1-hydroxy-2-[6-(6-pyridin-2-ylhexoxy)hexylamino]ethyl]phenol Traditional Name: 4-[1-hydroxy-2-[6-[6-(2-pyridyl)hexoxy]hexylamino]ethyl]-2-methylol-phenol Formula: C26H40N2O4 MolecularWeight: 444.6068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCCCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O

Isomeric SMILES

C1=CC=NC(=C1)CCCCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O

InChI

InChI=1S/C26H40N2O4/c29-21-23-19-22(13-14-25(23)30)26(31)20-27-15-7-2-4-10-18-32-17-9-3-1-5-11-24-12-6-8-16-28-24/h6,8,12-14,16,19,26-27,29-31H,1-5,7,9-11,15,17-18,20-21H2