N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-piperazin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-piperazin-1-ium-1-yl-ethanamide Openeye Name: N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-piperazin-1-ium-1-yl-acetamide CAS Name: N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-(1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-piperazin-1-ium-1-ylacetamide Traditional Name: N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-piperazin-1-ium-1-yl-acetamide Formula: C14H20Cl2N3O+ MolecularWeight: 317.2341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Cl)Cl)NC(=O)C[NH+]2CCNCC2

Isomeric SMILES

C[C@@H](C1=C(C=C(C=C1)Cl)Cl)NC(=O)C[NH+]2CCNCC2

InChI

InChI=1S/C14H19Cl2N3O/c1-10(12-3-2-11(15)8-13(12)16)18-14(20)9-19-6-4-17-5-7-19/h2-3,8,10,17H,4-7,9H2,1H3,(H,18,20)/p+1/t10-/m0/s1