N-[2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-2-phenyl-ethanamide Openeye Name: N-[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]-2-phenyl-acetamide CAS Name: N-[2-[4-[2-(4-chlorophenoxy)ethyl]-1-piperazin-4-iumyl]-2-oxoethyl]-2-phenylacetamide IUPAC Name: N-[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-4-ium-1-yl]-2-oxoethyl]-2-phenylacetamide Traditional Name: N-[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-4-ium-1-yl]-2-keto-ethyl]-2-phenyl-acetamide Formula: C22H27ClN3O3+ MolecularWeight: 416.92108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=C(C=C2)Cl)C(=O)CNC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=C(C=C2)Cl)C(=O)CNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H26ClN3O3/c23-19-6-8-20(9-7-19)29-15-14-25-10-12-26(13-11-25)22(28)17-24-21(27)16-18-4-2-1-3-5-18/h1-9H,10-17H2,(H,24,27)/p+1