(2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide

Systemtic Name: (2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide Openeye Name: (2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide CAS Name: (2R)-2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide IUPAC Name: (2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide Traditional Name: (2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-[2-(4-methoxyphenyl)ethyl]propionamide Formula: C22H29FN3O2+ MolecularWeight: 386.482963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=C(C=C1)OC)[NH+]2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=C(C=C1)OC)[NH+]2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H28FN3O2/c1-17(22(27)24-12-11-18-3-9-21(28-2)10-4-18)25-13-15-26(16-14-25)20-7-5-19(23)6-8-20/h3-10,17H,11-16H2,1-2H3,(H,24,27)/p+1/t17-/m1/s1