methyl 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[4-(4-fluorophenyl)piperazino]methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C23H24FN3O2 MolecularWeight: 393.453963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN3CCN(CC3)C4=CC=C(C=C4)F)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN3CCN(CC3)C4=CC=C(C=C4)F)C(=O)OC

InChI

InChI=1S/C23H24FN3O2/c1-16-19-5-3-4-6-20(19)25-21(22(16)23(28)29-2)15-26-11-13-27(14-12-26)18-9-7-17(24)8-10-18/h3-10H,11-15H2,1-2H3