1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone

Systemtic Name: 1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone Openeye Name: 1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone CAS Name: 1-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-2-(1-pyrrolidin-1-iumyl)ethanone IUPAC Name: 1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-pyrrolidin-1-ium-1-ylethanone Traditional Name: 1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone Formula: C21H29N3O+2 MolecularWeight: 339.47446

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](C1)CC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H27N3O/c25-21(17-22-10-3-4-11-22)24-14-12-23(13-15-24)16-19-8-5-7-18-6-1-2-9-20(18)19/h1-2,5-9H,3-4,10-17H2/p+2