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

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-indol-1-yl-ethanone Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-indol-1-yl-ethanone CAS Name: 1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-(1-indolyl)ethanone IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-indol-1-ylethanone Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-indol-1-yl-ethanone Formula: C27H28N3O+ MolecularWeight: 410.53072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CN4C=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CN4C=CC5=CC=CC=C54

InChI

InChI=1S/C27H27N3O/c31-26(21-30-16-15-22-9-7-8-14-25(22)30)28-17-19-29(20-18-28)27(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-16,27H,17-21H2/p+1