3-chloranylsulfonyl-4-propan-2-yl-benzoic acid

Systemtic Name: 3-chloranylsulfonyl-4-propan-2-yl-benzoic acid Openeye Name: 3-chlorosulfonyl-4-isopropyl-benzoic acid CAS Name: 3-chlorosulfonyl-4-propan-2-ylbenzoic acid IUPAC Name: 3-chlorosulfonyl-4-propan-2-ylbenzoic acid Traditional Name: 3-chlorosulfonyl-4-isopropyl-benzoic acid Formula: C10H11ClO4S MolecularWeight: 262.70994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11ClO4S/c1-6(2)8-4-3-7(10(12)13)5-9(8)16(11,14)15/h3-6H,1-2H3,(H,12,13)