2-naphthalen-2-yloxy-1-(4-pentan-3-ylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-naphthalen-2-yloxy-1-(4-pentan-3-ylpiperazin-4-ium-1-yl)ethanone Openeye Name: 1-[4-(1-ethylpropyl)piperazin-4-ium-1-yl]-2-(2-naphthyloxy)ethanone CAS Name: 2-(2-naphthalenyloxy)-1-(4-pentan-3-yl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-naphthalen-2-yloxy-1-(4-pentan-3-ylpiperazin-4-ium-1-yl)ethanone Traditional Name: 1-[4-(1-ethylpropyl)piperazin-4-ium-1-yl]-2-(2-naphthoxy)ethanone Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH+]1CCN(CC1)C(=O)COC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCC(CC)[NH+]1CCN(CC1)C(=O)COC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H28N2O2/c1-3-19(4-2)22-11-13-23(14-12-22)21(24)16-25-20-10-9-17-7-5-6-8-18(17)15-20/h5-10,15,19H,3-4,11-14,16H2,1-2H3/p+1