1-(diphenylmethyl)-4-(4-naphthalen-1-yloxybutyl)piperazin-1-ium chloride

Systemtic Name: 1-(diphenylmethyl)-4-(4-naphthalen-1-yloxybutyl)piperazin-1-ium chloride Openeye Name: 1-benzhydryl-4-[4-(1-naphthyloxy)butyl]piperazin-1-ium chloride CAS Name: 1-(diphenylmethyl)-4-[4-(1-naphthalenyloxy)butyl]piperazin-1-ium chloride IUPAC Name: 1-benzhydryl-4-(4-naphthalen-1-yloxybutyl)piperazin-1-ium chloride Traditional Name: 1-benzhydryl-4-[4-(1-naphthoxy)butyl]piperazin-1-ium chloride Formula: C31H35ClN2O MolecularWeight: 487.0754

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)CCCCOC4=CC=CC5=CC=CC=C54.[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)CCCCOC4=CC=CC5=CC=CC=C54.[Cl-]

InChI

InChI=1S/C31H34N2O.ClH/c1-3-13-27(14-4-1)31(28-15-5-2-6-16-28)33-23-21-32(22-24-33)20-9-10-25-34-30-19-11-17-26-12-7-8-18-29(26)30;/h1-8,11-19,31H,9-10,20-25H2;1H