1-(4-fluorophenyl)-4-(naphthalen-2-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(4-fluorophenyl)-4-(naphthalen-2-ylmethyl)piperazin-4-ium Openeye Name: 1-(4-fluorophenyl)-4-(2-naphthylmethyl)piperazin-4-ium CAS Name: 1-(4-fluorophenyl)-4-(2-naphthalenylmethyl)piperazin-4-ium IUPAC Name: 1-(4-fluorophenyl)-4-(naphthalen-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(4-fluorophenyl)-4-(2-naphthylmethyl)piperazin-4-ium Formula: C21H22FN2+ MolecularWeight: 321.411183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC3=CC=CC=C3C=C2)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC3=CC=CC=C3C=C2)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN2/c22-20-7-9-21(10-8-20)24-13-11-23(12-14-24)16-17-5-6-18-3-1-2-4-19(18)15-17/h1-10,15H,11-14,16H2/p+1