4-octoxycarbonylbenzenesulfonic acid

Systemtic Name: 4-octoxycarbonylbenzenesulfonic acid Openeye Name: 4-octoxycarbonylbenzenesulfonic acid CAS Name: 4-[octoxy(oxo)methyl]benzenesulfonic acid IUPAC Name: 4-octoxycarbonylbenzenesulfonic acid Traditional Name: 4-octoxycarbonylbesylic acid Formula: C15H22O5S MolecularWeight: 314.39718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O5S/c1-2-3-4-5-6-7-12-20-15(16)13-8-10-14(11-9-13)21(17,18)19/h8-11H,2-7,12H2,1H3,(H,17,18,19)