1,3-benzodioxol-5-yl 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: 1,3-benzodioxol-5-yl 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid 1,3-benzodioxol-5-yl ester Formula: C15H11ClO6S MolecularWeight: 354.76224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H11ClO6S/c1-23(18,19)10-3-4-12(16)11(7-10)15(17)22-9-2-5-13-14(6-9)21-8-20-13/h2-7H,8H2,1H3