N-[2-[[4-[(4-fluorophenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]quinolin-6-yl]ethanamide

Systemtic Name: N-[2-[[4-[(4-fluorophenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]quinolin-6-yl]ethanamide Openeye Name: N-[2-[[4-[(4-fluorophenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-quinolyl]acetamide CAS Name: N-[2-[[4-[(4-fluorophenyl)methyl]-3-(2-hydroxyethyl)-1-piperazinyl]methyl]-6-quinolinyl]acetamide IUPAC Name: N-[2-[[4-[(4-fluorophenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]quinolin-6-yl]acetamide Traditional Name: N-[2-[[4-(4-fluorobenzyl)-3-(2-hydroxyethyl)piperazino]methyl]-6-quinolyl]acetamide Formula: C25H29FN4O2 MolecularWeight: 436.521763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(C=C2)CN3CCN(C(C3)CCO)CC4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(C=C2)CN3CCN(C(C3)CCO)CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H29FN4O2/c1-18(32)27-22-8-9-25-20(14-22)4-7-23(28-25)16-29-11-12-30(24(17-29)10-13-31)15-19-2-5-21(26)6-3-19/h2-9,14,24,31H,10-13,15-17H2,1H3,(H,27,32)