2-[4-(2-chloranylethanoyl)piperazin-1-ium-1-yl]ethanesulfonate

Systemtic Name: 2-[4-(2-chloranylethanoyl)piperazin-1-ium-1-yl]ethanesulfonate Openeye Name: 2-[4-(2-chloroacetyl)piperazin-1-ium-1-yl]ethanesulfonate CAS Name: 2-[4-(2-chloro-1-oxoethyl)-1-piperazin-1-iumyl]ethanesulfonate IUPAC Name: 2-[4-(2-chloroacetyl)piperazin-1-ium-1-yl]ethanesulfonate Traditional Name: 2-[4-(2-chloroacetyl)piperazin-1-ium-1-yl]ethanesulfonate Formula: C8H15ClN2O4S MolecularWeight: 270.7337

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCS(=O)(=O)[O-])C(=O)CCl

Isomeric SMILES

C1CN(CC[NH+]1CCS(=O)(=O)[O-])C(=O)CCl

InChI

InChI=1S/C8H15ClN2O4S/c9-7-8(12)11-3-1-10(2-4-11)5-6-16(13,14)15/h1-7H2,(H,13,14,15)