2-naphthalen-2-yl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-naphthalen-2-yl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethanone Openeye Name: 2-(2-naphthyl)-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethanone CAS Name: 2-(2-naphthalenyl)-1-[4-(4-pyridin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2-naphthalen-2-yl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethanone Traditional Name: 2-(2-naphthyl)-1-(4-pyridin-1-ium-4-ylpiperazino)ethanone Formula: C21H22N3O+ MolecularWeight: 332.41888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H21N3O/c25-21(16-17-5-6-18-3-1-2-4-19(18)15-17)24-13-11-23(12-14-24)20-7-9-22-10-8-20/h1-10,15H,11-14,16H2/p+1