5-chloranyl-3-phenyl-2-sulfo-benzoic acid

Systemtic Name: 5-chloranyl-3-phenyl-2-sulfo-benzoic acid Openeye Name: 5-chloro-3-phenyl-2-sulfo-benzoic acid CAS Name: 5-chloro-3-phenyl-2-sulfobenzoic acid IUPAC Name: 5-chloro-3-phenyl-2-sulfobenzoic acid Traditional Name: 5-chloro-3-phenyl-2-sulfo-benzoic acid Formula: C13H9ClO5S MolecularWeight: 312.72556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC(=C2S(=O)(=O)O)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC(=C2S(=O)(=O)O)C(=O)O)Cl

InChI

InChI=1S/C13H9ClO5S/c14-9-6-10(8-4-2-1-3-5-8)12(20(17,18)19)11(7-9)13(15)16/h1-7H,(H,15,16)(H,17,18,19)