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

Systemtic Name: 1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-(2-nitrophenoxy)ethanone Openeye Name: 1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-2-(2-nitrophenoxy)ethanone CAS Name: 1-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-2-(2-nitrophenoxy)ethanone IUPAC Name: 1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-(2-nitrophenoxy)ethanone Traditional Name: 1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-2-(2-nitrophenoxy)ethanone Formula: C23H24N3O4+ MolecularWeight: 406.45436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)COC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O4/c27-23(17-30-22-11-4-3-10-21(22)26(28)29)25-14-12-24(13-15-25)16-19-8-5-7-18-6-1-2-9-20(18)19/h1-11H,12-17H2/p+1