1-(diphenylmethyl)-4-[4-(4-fluoranylphenoxy)butyl]piperazin-4-ium

Systemtic Name: 1-(diphenylmethyl)-4-[4-(4-fluoranylphenoxy)butyl]piperazin-4-ium Openeye Name: 1-benzhydryl-4-[4-(4-fluorophenoxy)butyl]piperazin-4-ium CAS Name: 1-(diphenylmethyl)-4-[4-(4-fluorophenoxy)butyl]piperazin-4-ium IUPAC Name: 1-benzhydryl-4-[4-(4-fluorophenoxy)butyl]piperazin-4-ium Traditional Name: 1-benzhydryl-4-[4-(4-fluorophenoxy)butyl]piperazin-4-ium Formula: C27H32FN2O+ MolecularWeight: 419.554183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCCOC2=CC=C(C=C2)F)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCCCOC2=CC=C(C=C2)F)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H31FN2O/c28-25-13-15-26(16-14-25)31-22-8-7-17-29-18-20-30(21-19-29)27(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27H,7-8,17-22H2/p+1