2-[4-[2-(4-chloranylnaphthalen-1-yl)oxyethanoyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[2-(4-chloranylnaphthalen-1-yl)oxyethanoyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[2-[(4-chloro-1-naphthyl)oxy]acetyl]piperazin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[2-[(4-chloro-1-naphthalenyl)oxy]-1-oxoethyl]-1-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-[2-(4-chloronaphthalen-1-yl)oxyacetyl]piperazin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-[2-(4-chloro-1-naphthoxy)acetyl]piperazin-1-ium-1-yl]-N-propyl-acetamide Formula: C21H27ClN3O3+ MolecularWeight: 404.91038

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)COC2=CC=C(C3=CC=CC=C32)Cl

Isomeric SMILES

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)COC2=CC=C(C3=CC=CC=C32)Cl

InChI

InChI=1S/C21H26ClN3O3/c1-2-9-23-20(26)14-24-10-12-25(13-11-24)21(27)15-28-19-8-7-18(22)16-5-3-4-6-17(16)19/h3-8H,2,9-15H2,1H3,(H,23,26)/p+1