(E)-3-(4-octoxyphenyl)-1-pyridin-2-yl-prop-2-en-1-one

Systemtic Name: (E)-3-(4-octoxyphenyl)-1-pyridin-2-yl-prop-2-en-1-one Openeye Name: (E)-3-(4-octoxyphenyl)-1-(2-pyridyl)prop-2-en-1-one CAS Name: (E)-3-(4-octoxyphenyl)-1-(2-pyridinyl)-2-propen-1-one IUPAC Name: (E)-3-(4-octoxyphenyl)-1-pyridin-2-ylprop-2-en-1-one Traditional Name: (E)-3-(4-octoxyphenyl)-1-(2-pyridyl)prop-2-en-1-one Formula: C22H27NO2 MolecularWeight: 337.45528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C=CC(=O)C2=CC=CC=N2

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)/C=C/C(=O)C2=CC=CC=N2

InChI

InChI=1S/C22H27NO2/c1-2-3-4-5-6-9-18-25-20-14-11-19(12-15-20)13-16-22(24)21-10-7-8-17-23-21/h7-8,10-17H,2-6,9,18H2,1H3/b16-13+