6-(octanoylamino)hexyl methanesulfonate

Systemtic Name: 6-(octanoylamino)hexyl methanesulfonate Openeye Name: 6-(octanoylamino)hexyl methanesulfonate CAS Name: methanesulfonic acid 6-(1-oxooctylamino)hexyl ester IUPAC Name: 6-(octanoylamino)hexyl methanesulfonate Traditional Name: methanesulfonic acid 6-(caprylylamino)hexyl ester Formula: C15H31NO4S MolecularWeight: 321.47594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCCCCCCOS(=O)(=O)C

Isomeric SMILES

CCCCCCCC(=O)NCCCCCCOS(=O)(=O)C

InChI

InChI=1S/C15H31NO4S/c1-3-4-5-6-9-12-15(17)16-13-10-7-8-11-14-20-21(2,18)19/h3-14H2,1-2H3,(H,16,17)