2-[4-[2-(4-chloranylphenoxy)ethanoyl]piperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-[2-(4-chloranylphenoxy)ethanoyl]piperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[2-(4-chlorophenoxy)-1-oxoethyl]-1-piperazin-1-iumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-ium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide Formula: C17H23ClN3O3+ MolecularWeight: 352.83582

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)COC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H22ClN3O3/c18-13-1-5-15(6-2-13)24-12-17(23)21-9-7-20(8-10-21)11-16(22)19-14-3-4-14/h1-2,5-6,14H,3-4,7-12H2,(H,19,22)/p+1