(2S)-2-chloranyl-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: (2S)-2-chloranyl-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: (2S)-2-chloro-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one CAS Name: (2S)-2-chloro-1-(4-ethyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: (2S)-2-chloro-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: (2S)-2-chloro-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Formula: C9H18ClN2O+ MolecularWeight: 205.70502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17ClN2O/c1-3-11-4-6-12(7-5-11)9(13)8(2)10/h8H,3-7H2,1-2H3/p+1/t8-/m0/s1