6-(2-imidazol-1-yl-1-pyridin-2-yl-ethoxy)-5-phenethyl-3,4-dihydro-2H-naphthalen-1-one

Systemtic Name: 6-(2-imidazol-1-yl-1-pyridin-2-yl-ethoxy)-5-phenethyl-3,4-dihydro-2H-naphthalen-1-one Openeye Name: 6-[2-imidazol-1-yl-1-(2-pyridyl)ethoxy]-5-phenethyl-tetralin-1-one CAS Name: 6-[2-(1-imidazolyl)-1-(2-pyridinyl)ethoxy]-5-phenethyl-3,4-dihydro-2H-naphthalen-1-one IUPAC Name: 6-(2-imidazol-1-yl-1-pyridin-2-ylethoxy)-5-phenethyl-3,4-dihydro-2H-naphthalen-1-one Traditional Name: 6-[2-imidazol-1-yl-1-(2-pyridyl)ethoxy]-5-phenethyl-tetralin-1-one Formula: C28H27N3O2 MolecularWeight: 437.53288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2CCC3=CC=CC=C3)OC(CN4C=CN=C4)C5=CC=CC=N5)C(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2CCC3=CC=CC=C3)OC(CN4C=CN=C4)C5=CC=CC=N5)C(=O)C1

InChI

InChI=1S/C28H27N3O2/c32-26-11-6-9-22-23(26)14-15-27(24(22)13-12-21-7-2-1-3-8-21)33-28(19-31-18-17-29-20-31)25-10-4-5-16-30-25/h1-5,7-8,10,14-18,20,28H,6,9,11-13,19H2