2-bromanyldecan-4-yl benzenesulfonate

Systemtic Name: 2-bromanyldecan-4-yl benzenesulfonate Openeye Name: 1-(2-bromopropyl)heptyl benzenesulfonate CAS Name: benzenesulfonic acid 2-bromodecan-4-yl ester IUPAC Name: 2-bromodecan-4-yl benzenesulfonate Traditional Name: benzenesulfonic acid 1-(2-bromopropyl)heptyl ester Formula: C16H25BrO3S MolecularWeight: 377.3369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC(C)Br)OS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCC(CC(C)Br)OS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C16H25BrO3S/c1-3-4-5-7-10-15(13-14(2)17)20-21(18,19)16-11-8-6-9-12-16/h6,8-9,11-12,14-15H,3-5,7,10,13H2,1-2H3