[2-(octanoylamino)oxysulfonylphenyl] hexanoate

Systemtic Name: [2-(octanoylamino)oxysulfonylphenyl] hexanoate Openeye Name: [2-(octanoylamino)oxysulfonylphenyl] hexanoate CAS Name: hexanoic acid [2-(1-oxooctylamino)oxysulfonylphenyl] ester IUPAC Name: [2-(octanoylamino)oxysulfonylphenyl] hexanoate Traditional Name: hexanoic acid [2-(caprylylamino)oxysulfonylphenyl] ester Formula: C20H31NO6S MolecularWeight: 413.52824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NOS(=O)(=O)C1=CC=CC=C1OC(=O)CCCCC

Isomeric SMILES

CCCCCCCC(=O)NOS(=O)(=O)C1=CC=CC=C1OC(=O)CCCCC

InChI

InChI=1S/C20H31NO6S/c1-3-5-7-8-10-15-19(22)21-27-28(24,25)18-14-12-11-13-17(18)26-20(23)16-9-6-4-2/h11-14H,3-10,15-16H2,1-2H3,(H,21,22)