potassium 2-[[3-(chloromethyl)phenyl]carbonylamino]ethanesulfonate

Systemtic Name: potassium 2-[[3-(chloromethyl)phenyl]carbonylamino]ethanesulfonate Openeye Name: potassium 2-[[3-(chloromethyl)benzoyl]amino]ethanesulfonate CAS Name: potassium 2-[[[3-(chloromethyl)phenyl]-oxomethyl]amino]ethanesulfonate IUPAC Name: potassium 2-[[3-(chloromethyl)benzoyl]amino]ethanesulfonate Traditional Name: potassium 2-[[3-(chloromethyl)benzoyl]amino]ethanesulfonate Formula: C10H11ClKNO4S MolecularWeight: 315.81494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CCl)C(=O)NCCS(=O)(=O)[O-].[K+]

Isomeric SMILES

C1=CC(=CC(=C1)CCl)C(=O)NCCS(=O)(=O)[O-].[K+]

InChI

InChI=1S/C10H12ClNO4S.K/c11-7-8-2-1-3-9(6-8)10(13)12-4-5-17(14,15)16;/h1-3,6H,4-5,7H2,(H,12,13)(H,14,15,16);/q;+1/p-1