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

Systemtic Name: 1-(4-chlorophenyl)-2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-1-(4-chlorophenyl)ethanone CAS Name: 1-(4-chlorophenyl)-2-[4-(diphenylmethyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-1-(4-chlorophenyl)ethanone Traditional Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-1-(4-chlorophenyl)ethanone Formula: C25H26ClN2O+ MolecularWeight: 405.93974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25ClN2O/c26-23-13-11-20(12-14-23)24(29)19-27-15-17-28(18-16-27)25(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,25H,15-19H2/p+1