2-[[4-[2-(4-fluoranylphenoxy)ethanoyl]piperazin-1-yl]methyl]-5,7-dimethyl-1H-quinolin-4-one

Systemtic Name: 2-[[4-[2-(4-fluoranylphenoxy)ethanoyl]piperazin-1-yl]methyl]-5,7-dimethyl-1H-quinolin-4-one Openeye Name: 2-[[4-[2-(4-fluorophenoxy)acetyl]piperazin-1-yl]methyl]-5,7-dimethyl-1H-quinolin-4-one CAS Name: 2-[[4-[2-(4-fluorophenoxy)-1-oxoethyl]-1-piperazinyl]methyl]-5,7-dimethyl-1H-quinolin-4-one IUPAC Name: 2-[[4-[2-(4-fluorophenoxy)acetyl]piperazin-1-yl]methyl]-5,7-dimethyl-1H-quinolin-4-one Traditional Name: 2-[[4-[2-(4-fluorophenoxy)acetyl]piperazino]methyl]-5,7-dimethyl-4-quinolone Formula: C24H26FN3O3 MolecularWeight: 423.479943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)NC(=CC2=O)CN3CCN(CC3)C(=O)COC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=C2C(=C1)NC(=CC2=O)CN3CCN(CC3)C(=O)COC4=CC=C(C=C4)F)C

InChI

InChI=1S/C24H26FN3O3/c1-16-11-17(2)24-21(12-16)26-19(13-22(24)29)14-27-7-9-28(10-8-27)23(30)15-31-20-5-3-18(25)4-6-20/h3-6,11-13H,7-10,14-15H2,1-2H3,(H,26,29)