1-[4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-1-piperidyl]-3-methyl-butan-1-one CAS Name: 1-[4-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-1-piperidinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]piperidino]-3-methyl-butan-1-one Formula: C20H31FN3O+ MolecularWeight: 348.478043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC(CC1)[NH+]2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC(C)CC(=O)N1CCC(CC1)[NH+]2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C20H30FN3O/c1-16(2)15-20(25)24-9-7-17(8-10-24)22-11-13-23(14-12-22)19-6-4-3-5-18(19)21/h3-6,16-17H,7-15H2,1-2H3/p+1