(2S)-2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-ethanamide Openeye Name: (2S)-2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-acetamide CAS Name: (2S)-2-[4-(2-chlorophenyl)-1-piperazin-1-iumyl]-N,N-dimethyl-2-phenylacetamide IUPAC Name: (2S)-2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-2-phenylacetamide Traditional Name: (2S)-2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-acetamide Formula: C20H25ClN3O+ MolecularWeight: 358.885

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)[NH+]2CCN(CC2)C3=CC=CC=C3Cl

Isomeric SMILES

CN(C)C(=O)[C@H](C1=CC=CC=C1)[NH+]2CCN(CC2)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H24ClN3O/c1-22(2)20(25)19(16-8-4-3-5-9-16)24-14-12-23(13-15-24)18-11-7-6-10-17(18)21/h3-11,19H,12-15H2,1-2H3/p+1/t19-/m0/s1