(2S)-N-(2-fluorophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(2-fluorophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(2-fluorophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(2-fluorophenyl)-2-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: (2S)-N-(2-fluorophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-(2-fluorophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C19H23FN3O+ MolecularWeight: 328.403823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1F)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1F)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H22FN3O/c1-15(19(24)21-18-10-6-5-9-17(18)20)22-11-13-23(14-12-22)16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3,(H,21,24)/p+1/t15-/m0/s1