4-bromanyl-5-chloranylsulfonyl-2-propyl-benzoic acid

Systemtic Name: 4-bromanyl-5-chloranylsulfonyl-2-propyl-benzoic acid Openeye Name: 4-bromo-5-chlorosulfonyl-2-propyl-benzoic acid CAS Name: 4-bromo-5-chlorosulfonyl-2-propylbenzoic acid IUPAC Name: 4-bromo-5-chlorosulfonyl-2-propylbenzoic acid Traditional Name: 4-bromo-5-chlorosulfonyl-2-propyl-benzoic acid Formula: C10H10BrClO4S MolecularWeight: 341.606

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)Cl)Br

Isomeric SMILES

CCCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)Cl)Br

InChI

InChI=1S/C10H10BrClO4S/c1-2-3-6-4-8(11)9(17(12,15)16)5-7(6)10(13)14/h4-5H,2-3H2,1H3,(H,13,14)