2-(phenylcarbonyl)cyclohexane-1-sulfonate

Systemtic Name: 2-(phenylcarbonyl)cyclohexane-1-sulfonate Openeye Name: 2-benzoylcyclohexanesulfonate CAS Name: 2-benzoyl-1-cyclohexanesulfonate IUPAC Name: 2-benzoylcyclohexane-1-sulfonate Traditional Name: 2-benzoylcyclohexanesulfonate Formula: C13H15O4S- MolecularWeight: 267.3208

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)C2=CC=CC=C2)S(=O)(=O)[O-]

Isomeric SMILES

C1CCC(C(C1)C(=O)C2=CC=CC=C2)S(=O)(=O)[O-]

InChI

InChI=1S/C13H16O4S/c14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)18(15,16)17/h1-3,6-7,11-12H,4-5,8-9H2,(H,15,16,17)/p-1