4-(2-chloranyloctanoyloxy)benzenesulfonic acid

Systemtic Name: 4-(2-chloranyloctanoyloxy)benzenesulfonic acid Openeye Name: 4-(2-chlorooctanoyloxy)benzenesulfonic acid CAS Name: 4-(2-chloro-1-oxooctoxy)benzenesulfonic acid IUPAC Name: 4-(2-chlorooctanoyloxy)benzenesulfonic acid Traditional Name: 4-(2-chlorooctanoyloxy)besylic acid Formula: C14H19ClO5S MolecularWeight: 334.81566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OC1=CC=C(C=C1)S(=O)(=O)O)Cl

Isomeric SMILES

CCCCCCC(C(=O)OC1=CC=C(C=C1)S(=O)(=O)O)Cl

InChI

InChI=1S/C14H19ClO5S/c1-2-3-4-5-6-13(15)14(16)20-11-7-9-12(10-8-11)21(17,18)19/h7-10,13H,2-6H2,1H3,(H,17,18,19)