4-[4-(trichloromethyl)phenyl]sulfonylbenzoic acid

Systemtic Name: 4-[4-(trichloromethyl)phenyl]sulfonylbenzoic acid Openeye Name: 4-[4-(trichloromethyl)phenyl]sulfonylbenzoic acid CAS Name: 4-[4-(trichloromethyl)phenyl]sulfonylbenzoic acid IUPAC Name: 4-[4-(trichloromethyl)phenyl]sulfonylbenzoic acid Traditional Name: 4-[4-(trichloromethyl)phenyl]sulfonylbenzoic acid Formula: C14H9Cl3O4S MolecularWeight: 379.64286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)C(Cl)(Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)C(Cl)(Cl)Cl

InChI

InChI=1S/C14H9Cl3O4S/c15-14(16,17)10-3-7-12(8-4-10)22(20,21)11-5-1-9(2-6-11)13(18)19/h1-8H,(H,18,19)