3-(3-chloranylpropoxycarbonyl)benzenesulfonic acid

Systemtic Name: 3-(3-chloranylpropoxycarbonyl)benzenesulfonic acid Openeye Name: 3-(3-chloropropoxycarbonyl)benzenesulfonic acid CAS Name: 3-[3-chloropropoxy(oxo)methyl]benzenesulfonic acid IUPAC Name: 3-(3-chloropropoxycarbonyl)benzenesulfonic acid Traditional Name: 3-(3-chloropropoxycarbonyl)besylic acid Formula: C10H11ClO5S MolecularWeight: 278.70934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11ClO5S/c11-5-2-6-16-10(12)8-3-1-4-9(7-8)17(13,14)15/h1,3-4,7H,2,5-6H2,(H,13,14,15)