(2S)-1-(4-fluorophenyl)-2-phenyl-3-piperazin-4-ium-1-yl-propan-1-one

Systemtic Name: (2S)-1-(4-fluorophenyl)-2-phenyl-3-piperazin-4-ium-1-yl-propan-1-one Openeye Name: (2S)-1-(4-fluorophenyl)-2-phenyl-3-piperazin-4-ium-1-yl-propan-1-one CAS Name: (2S)-1-(4-fluorophenyl)-2-phenyl-3-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: (2S)-1-(4-fluorophenyl)-2-phenyl-3-piperazin-4-ium-1-ylpropan-1-one Traditional Name: (2S)-1-(4-fluorophenyl)-2-phenyl-3-piperazin-4-ium-1-yl-propan-1-one Formula: C19H22FN2O+ MolecularWeight: 313.389183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC(C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH2+]1)C[C@H](C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H21FN2O/c20-17-8-6-16(7-9-17)19(23)18(15-4-2-1-3-5-15)14-22-12-10-21-11-13-22/h1-9,18,21H,10-14H2/p+1/t18-/m1/s1