3-[6-[4-[6-(hydroxymethyloxy)hexoxy]phenyl]pyridin-3-yl]prop-2-yn-1-ol

Systemtic Name: 3-[6-[4-[6-(hydroxymethyloxy)hexoxy]phenyl]pyridin-3-yl]prop-2-yn-1-ol Openeye Name: 3-[6-[4-[6-(hydroxymethoxy)hexoxy]phenyl]-3-pyridyl]prop-2-yn-1-ol CAS Name: 3-[6-[4-[6-(hydroxymethoxy)hexoxy]phenyl]-3-pyridinyl]-2-propyn-1-ol IUPAC Name: 3-[6-[4-[6-(hydroxymethoxy)hexoxy]phenyl]pyridin-3-yl]prop-2-yn-1-ol Traditional Name: 3-[6-[4-(6-methyloloxyhexoxy)phenyl]-3-pyridyl]prop-2-yn-1-ol Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=C(C=C2)C#CCO)OCCCCCCOCO

Isomeric SMILES

C1=CC(=CC=C1C2=NC=C(C=C2)C#CCO)OCCCCCCOCO

InChI

InChI=1S/C21H25NO4/c23-13-5-6-18-7-12-21(22-16-18)19-8-10-20(11-9-19)26-15-4-2-1-3-14-25-17-24/h7-12,16,23-24H,1-4,13-15,17H2