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

Systemtic Name: 2-chloranyl-1-oxidanyl-3-phenyl-propane-1-sulfonic acid Openeye Name: 2-chloro-1-hydroxy-3-phenyl-propane-1-sulfonic acid CAS Name: 2-chloro-1-hydroxy-3-phenyl-1-propanesulfonic acid IUPAC Name: 2-chloro-1-hydroxy-3-phenylpropane-1-sulfonic acid Traditional Name: 2-chloro-1-hydroxy-3-phenyl-propane-1-sulfonic acid Formula: C9H11ClO4S MolecularWeight: 250.69924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11ClO4S/c10-8(9(11)15(12,13)14)6-7-4-2-1-3-5-7/h1-5,8-9,11H,6H2,(H,12,13,14)