1-oxidanyl-3-phenyl-propane-1-sulfonic acid

Systemtic Name: 1-oxidanyl-3-phenyl-propane-1-sulfonic acid Openeye Name: 1-hydroxy-3-phenyl-propane-1-sulfonic acid CAS Name: 1-hydroxy-3-phenyl-1-propanesulfonic acid IUPAC Name: 1-hydroxy-3-phenylpropane-1-sulfonic acid Traditional Name: 1-hydroxy-3-phenyl-propane-1-sulfonic acid Formula: C9H12O4S MolecularWeight: 216.25418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC(O)S(=O)(=O)O

InChI

InChI=1S/C9H12O4S/c10-9(14(11,12)13)7-6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,11,12,13)