2-chloranyl-5-dodecanoyl-benzenesulfonic acid

Systemtic Name: 2-chloranyl-5-dodecanoyl-benzenesulfonic acid Openeye Name: 2-chloro-5-dodecanoyl-benzenesulfonic acid CAS Name: 2-chloro-5-(1-oxododecyl)benzenesulfonic acid IUPAC Name: 2-chloro-5-dodecanoylbenzenesulfonic acid Traditional Name: 2-chloro-5-lauroyl-besylic acid Formula: C18H27ClO4S MolecularWeight: 374.92258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)O

InChI

InChI=1S/C18H27ClO4S/c1-2-3-4-5-6-7-8-9-10-11-17(20)15-12-13-16(19)18(14-15)24(21,22)23/h12-14H,2-11H2,1H3,(H,21,22,23)