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

Systemtic Name: 2-[4-[2-(4-chloranylnaphthalen-1-yl)oxyethanoyl]piperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-[2-[(4-chloro-1-naphthyl)oxy]acetyl]piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[2-[(4-chloro-1-naphthalenyl)oxy]-1-oxoethyl]-1-piperazin-1-iumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-[2-(4-chloronaphthalen-1-yl)oxyacetyl]piperazin-1-ium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-[2-(4-chloro-1-naphthoxy)acetyl]piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide Formula: C21H25ClN3O3+ MolecularWeight: 402.8945

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)COC3=CC=C(C4=CC=CC=C43)Cl

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)COC3=CC=C(C4=CC=CC=C43)Cl

InChI

InChI=1S/C21H24ClN3O3/c22-18-7-8-19(17-4-2-1-3-16(17)18)28-14-21(27)25-11-9-24(10-12-25)13-20(26)23-15-5-6-15/h1-4,7-8,15H,5-6,9-14H2,(H,23,26)/p+1