2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)ethanamide Openeye Name: 2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)acetamide CAS Name: 2-[4-[2-(4-chlorophenoxy)ethyl]-1-piperazin-1-iumyl]-N-(2-cyclopentyl-3-pyrazolyl)acetamide IUPAC Name: 2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)acetamide Traditional Name: 2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)acetamide Formula: C22H31ClN5O2+ MolecularWeight: 432.96684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC=N2)NC(=O)C[NH+]3CCN(CC3)CCOC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(C1)N2C(=CC=N2)NC(=O)C[NH+]3CCN(CC3)CCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H30ClN5O2/c23-18-5-7-20(8-6-18)30-16-15-26-11-13-27(14-12-26)17-22(29)25-21-9-10-24-28(21)19-3-1-2-4-19/h5-10,19H,1-4,11-17H2,(H,25,29)/p+1