2,2-dimethyl-7-pentyl-4-[1-(pyridin-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]-3,4-dihydrochromen-5-ol

Systemtic Name: 2,2-dimethyl-7-pentyl-4-[1-(pyridin-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]-3,4-dihydrochromen-5-ol Openeye Name: 2,2-dimethyl-7-pentyl-4-[1-(3-pyridylmethyl)-3,6-dihydro-2H-pyridin-4-yl]chroman-5-ol CAS Name: 2,2-dimethyl-7-pentyl-4-[1-(3-pyridinylmethyl)-3,6-dihydro-2H-pyridin-4-yl]-3,4-dihydro-2H-1-benzopyran-5-ol IUPAC Name: 2,2-dimethyl-7-pentyl-4-[1-(pyridin-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]-3,4-dihydrochromen-5-ol Traditional Name: 7-amyl-2,2-dimethyl-4-[1-(3-pyridylmethyl)-3,6-dihydro-2H-pyridin-4-yl]chroman-5-ol Formula: C27H36N2O2 MolecularWeight: 420.58694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C(CC(O2)(C)C)C3=CCN(CC3)CC4=CN=CC=C4)C(=C1)O

Isomeric SMILES

CCCCCC1=CC2=C(C(CC(O2)(C)C)C3=CCN(CC3)CC4=CN=CC=C4)C(=C1)O

InChI

InChI=1S/C27H36N2O2/c1-4-5-6-8-20-15-24(30)26-23(17-27(2,3)31-25(26)16-20)22-10-13-29(14-11-22)19-21-9-7-12-28-18-21/h7,9-10,12,15-16,18,23,30H,4-6,8,11,13-14,17,19H2,1-3H3