4-oxidanylidene-5-phenyl-pentane-1-sulfonic acid

Systemtic Name: 4-oxidanylidene-5-phenyl-pentane-1-sulfonic acid Openeye Name: 4-oxo-5-phenyl-pentane-1-sulfonic acid CAS Name: 4-oxo-5-phenyl-1-pentanesulfonic acid IUPAC Name: 4-oxo-5-phenylpentane-1-sulfonic acid Traditional Name: 4-keto-5-phenyl-pentane-1-sulfonic acid Formula: C11H14O4S MolecularWeight: 242.29146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)CCCS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)CCCS(=O)(=O)O

InChI

InChI=1S/C11H14O4S/c12-11(7-4-8-16(13,14)15)9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,13,14,15)