(2S)-2-chloranyl-N-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-chloranyl-N-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-ethanamide Openeye Name: (2S)-2-chloro-N-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-acetamide CAS Name: (2S)-2-chloro-N-(4-methyl-1-piperazin-4-iumyl)-2-phenylacetamide IUPAC Name: (2S)-2-chloro-N-(4-methylpiperazin-4-ium-1-yl)-2-phenylacetamide Traditional Name: (2S)-2-chloro-N-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-acetamide Formula: C13H19ClN3O+ MolecularWeight: 268.76246

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C(C2=CC=CC=C2)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)[C@H](C2=CC=CC=C2)Cl

InChI

InChI=1S/C13H18ClN3O/c1-16-7-9-17(10-8-16)15-13(18)12(14)11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H,15,18)/p+1/t12-/m0/s1