4-(octanoylamino)butyl methanesulfonate

Systemtic Name: 4-(octanoylamino)butyl methanesulfonate Openeye Name: 4-(octanoylamino)butyl methanesulfonate CAS Name: methanesulfonic acid 4-(1-oxooctylamino)butyl ester IUPAC Name: 4-(octanoylamino)butyl methanesulfonate Traditional Name: methanesulfonic acid 4-(caprylylamino)butyl ester Formula: C13H27NO4S MolecularWeight: 293.42278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCCCCOS(=O)(=O)C

Isomeric SMILES

CCCCCCCC(=O)NCCCCOS(=O)(=O)C

InChI

InChI=1S/C13H27NO4S/c1-3-4-5-6-7-10-13(15)14-11-8-9-12-18-19(2,16)17/h3-12H2,1-2H3,(H,14,15)