N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide chloride

Systemtic Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide chloride Openeye Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide chloride CAS Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]propanamide chloride IUPAC Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanamide chloride Traditional Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propionamide chloride Formula: C15H23Cl2N3O2 MolecularWeight: 348.26802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=CC=C(C=C2)Cl)CCO.[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=CC=C(C=C2)Cl)CCO.[Cl-]

InChI

InChI=1S/C15H22ClN3O2.ClH/c16-13-1-3-14(4-2-13)17-15(21)5-6-18-7-9-19(10-8-18)11-12-20;/h1-4,20H,5-12H2,(H,17,21);1H