3,4-bis(chloranyl)-5-(phenylmethyl)sulfonyl-benzoic acid

Systemtic Name: 3,4-bis(chloranyl)-5-(phenylmethyl)sulfonyl-benzoic acid Openeye Name: 3-benzylsulfonyl-4,5-dichloro-benzoic acid CAS Name: 3,4-dichloro-5-(phenylmethyl)sulfonylbenzoic acid IUPAC Name: 3-benzylsulfonyl-4,5-dichlorobenzoic acid Traditional Name: 3-benzylsulfonyl-4,5-dichloro-benzoic acid Formula: C14H10Cl2O4S MolecularWeight: 345.1978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10Cl2O4S/c15-11-6-10(14(17)18)7-12(13(11)16)21(19,20)8-9-4-2-1-3-5-9/h1-7H,8H2,(H,17,18)