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

Systemtic Name: 1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-[4-(phenylcarbonyl)piperidin-1-ium-1-yl]ethanone Openeye Name: 2-(4-benzoylpiperidin-1-ium-1-yl)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-(4-benzoyl-1-piperidin-1-iumyl)-1-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(4-benzoylpiperidin-1-ium-1-yl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(4-benzoylpiperidin-1-ium-1-yl)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]ethanone Formula: C29H35N3O2+2 MolecularWeight: 457.6071

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)C2=CC=CC=C2)CC(=O)N3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1C[NH+](CCC1C(=O)C2=CC=CC=C2)CC(=O)N3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H33N3O2/c33-28(22-30-15-13-25(14-16-30)29(34)24-8-2-1-3-9-24)32-19-17-31(18-20-32)21-26-11-6-10-23-7-4-5-12-27(23)26/h1-12,25H,13-22H2/p+2