4-tert-butyl-3-chloranylsulfonyl-benzoic acid

Systemtic Name: 4-tert-butyl-3-chloranylsulfonyl-benzoic acid Openeye Name: 4-tert-butyl-3-chlorosulfonyl-benzoic acid CAS Name: 4-tert-butyl-3-chlorosulfonylbenzoic acid IUPAC Name: 4-tert-butyl-3-chlorosulfonylbenzoic acid Traditional Name: 4-tert-butyl-3-chlorosulfonyl-benzoic acid Formula: C11H13ClO4S MolecularWeight: 276.73652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13ClO4S/c1-11(2,3)8-5-4-7(10(13)14)6-9(8)17(12,15)16/h4-6H,1-3H3,(H,13,14)