7-[3-[[2-(heptylsulfonylamino)ethanoylamino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid

Systemtic Name: 7-[3-[[2-(heptylsulfonylamino)ethanoylamino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid Openeye Name: 7-[3-[[[2-(heptylsulfonylamino)acetyl]amino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid CAS Name: 7-[3-[[[2-(heptylsulfonylamino)-1-oxoethyl]amino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid IUPAC Name: 7-[3-[[[2-(heptylsulfonylamino)acetyl]amino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]heptanoic acid Traditional Name: 7-[3-[[[2-(heptylsulfonylamino)acetyl]amino]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]enanthic acid Formula: C23H42N2O6S MolecularWeight: 474.65438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCS(=O)(=O)NCC(=O)NCC1C2CCC(C1CCCCCCC(=O)O)O2

Isomeric SMILES

CCCCCCCS(=O)(=O)NCC(=O)NCC1C2CCC(C1CCCCCCC(=O)O)O2

InChI

InChI=1S/C23H42N2O6S/c1-2-3-4-7-10-15-32(29,30)25-17-22(26)24-16-19-18(20-13-14-21(19)31-20)11-8-5-6-9-12-23(27)28/h18-21,25H,2-17H2,1H3,(H,24,26)(H,27,28)