1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-phenoxy-ethanone Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-phenoxy-ethanone CAS Name: 1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-phenoxyethanone IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-phenoxyethanone Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-phenoxy-ethanone Formula: C25H27N2O2+ MolecularWeight: 387.49408

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)COC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O2/c28-24(20-29-23-14-8-3-9-15-23)26-16-18-27(19-17-26)25(21-10-4-1-5-11-21)22-12-6-2-7-13-22/h1-15,25H,16-20H2/p+1