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

Systemtic Name: 1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-2-(4-phenyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Formula: C27H34N4O+2 MolecularWeight: 430.58506

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)C[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)C[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H32N4O/c32-27(22-29-13-17-30(18-14-29)25-10-2-1-3-11-25)31-19-15-28(16-20-31)21-24-9-6-8-23-7-4-5-12-26(23)24/h1-12H,13-22H2/p+2