2-[4-(2-naphthalen-2-yloxyethanoyl)piperazin-1-ium-1-yl]ethanoate

Systemtic Name: 2-[4-(2-naphthalen-2-yloxyethanoyl)piperazin-1-ium-1-yl]ethanoate Openeye Name: 2-[4-[2-(2-naphthyloxy)acetyl]piperazin-1-ium-1-yl]acetate CAS Name: 2-[4-[2-(2-naphthalenyloxy)-1-oxoethyl]-1-piperazin-1-iumyl]acetate IUPAC Name: 2-[4-(2-naphthalen-2-yloxyacetyl)piperazin-1-ium-1-yl]acetate Traditional Name: 2-[4-[2-(2-naphthoxy)acetyl]piperazin-1-ium-1-yl]acetate Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)[O-])C(=O)COC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)[O-])C(=O)COC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H20N2O4/c21-17(20-9-7-19(8-10-20)12-18(22)23)13-24-16-6-5-14-3-1-2-4-15(14)11-16/h1-6,11H,7-10,12-13H2,(H,22,23)