4-[2-(6,7-diethoxynaphthalen-1-yl)ethynyl]-5-(4-fluorophenyl)-1H-pyrazole

Systemtic Name: 4-[2-(6,7-diethoxynaphthalen-1-yl)ethynyl]-5-(4-fluorophenyl)-1H-pyrazole Openeye Name: 4-[2-(6,7-diethoxy-1-naphthyl)ethynyl]-5-(4-fluorophenyl)-1H-pyrazole CAS Name: 4-[2-(6,7-diethoxy-1-naphthalenyl)ethynyl]-5-(4-fluorophenyl)-1H-pyrazole IUPAC Name: 4-[2-(6,7-diethoxynaphthalen-1-yl)ethynyl]-5-(4-fluorophenyl)-1H-pyrazole Traditional Name: 4-[2-(6,7-diethoxy-1-naphthyl)ethynyl]-5-(4-fluorophenyl)-1H-pyrazole Formula: C25H21FN2O2 MolecularWeight: 400.444843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC=CC(=C2C=C1OCC)C#CC3=C(NN=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC2=CC=CC(=C2C=C1OCC)C#CC3=C(NN=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H21FN2O2/c1-3-29-23-14-19-7-5-6-17(22(19)15-24(23)30-4-2)8-9-20-16-27-28-25(20)18-10-12-21(26)13-11-18/h5-7,10-16H,3-4H2,1-2H3,(H,27,28)